SCHEMBL104995

SCHEMBL104995

O=c1oc2cc(OCc3ccccc3)ccc2cc1C(F)(F)F

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 3/20 0.67
SLC16A3 O15427 2/20 0.65
MAOB P27338 10/20 0.62
MAOA P21397 5/20 0.62
MEN1 O00255 1/20 0.62
NPC1 O15118 1/20 0.62
CA12 O43570 1/20 0.62
CA1 P00915 1/20 0.62
CA2 P00918 1/20 0.62
CA3 P07451 1/20 0.62
CA4 P22748 1/20 0.62
CA6 P23280 1/20 0.62
CA7 P43166 1/20 0.62
MTNR1A P48039 1/20 0.62
KMT2A Q03164 1/20 0.62
CA9 Q16790 1/20 0.62
CA14 Q9ULX7 1/20 0.62
KDM4E B2RXH2 1/20 0.58
HPGD P15428 1/20 0.58
ACHE P22303 2/20 0.56

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL28438618 0.88 AR (0.68) ARSLC16A3MAOBMAOAKDM4E
SCHEMBL29724361 0.88 AR (0.68) ARSLC16A3MAOBMAOAKDM4E
SCHEMBL238751 0.80 AR (1.00) ARMAOBMAOANPC1
SCHEMBL31379014 0.79 GPR55 (0.49) ARSLC16A3MAOBMAOANPC1
SCHEMBL93260 0.79 SLC16A3 (1.00) SLC16A3MAOBMAOAMEN1NPC1
SCHEMBL29066609 0.79 SLC16A3 (0.70) SLC16A3MAOBMAOAMEN1NPC1
SCHEMBL4648135 0.79 SLC16A3 (0.66) SLC16A3MAOBMAOAMEN1NPC1
SCHEMBL1093778 0.78 MAOB (0.72) SLC16A3MAOBMAOAMEN1NPC1
SCHEMBL28776464 0.78 MAOB (0.67) ARMAOBMAOANPC1ACHE
SCHEMBL1712282 0.77 MAOB (0.57) SLC16A3MAOBMAOAMEN1NPC1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 321 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260091022-A1 PHARMACEUTICAL COMPOSITION FOR TREATING FATTY LIVER DISEASE SHIONOGI & CO., LTD. (JP) 2026-04-02 US disclosed
US-12521375-B2 Pharmaceutical composition for treating fatty liver disease SHIONOGI & CO., LTD. (JP) 2026-01-13 US disclosed
US-20250257072-A1 PHARMACEUTICAL COMPOSITIONS CONTAINING SUBSTITUTED POLYCYCLIC PYRIDONE DERIVATIVES AND PRODRUG THEREOF SHIONOGI & CO., LTD. (JP) 2025-08-14 US disclosed
CN-113717198-B Process for preparing substituted polycyclic pyridone derivatives and crystals thereof 盐野义制药株式会社 2025-03-07 CN disclosed
US-20250041279-A1 THERAPEUTIC MEDICINE FOR HEART DISEASE OR SKELETAL MUSCLE DISEASE SHIONOGI & CO., LTD. (JP) 2025-02-06 US disclosed
CN-112313238-B Tetrahydropyranoxazine derivatives with selective BACE1 inhibiting activity 盐野义制药株式会社 2025-01-17 CN disclosed
EP-4458348-A2 PHARMACEUTICAL COMPOSITIONS CONTAINING SUBSTITUTED POLYCYCLIC PYRIDONE DERIVATIVES AND PRODRUG THEREOF Shionogi & Co., Ltd (JP) 2024-11-06 EP disclosed
US-20240327424-A1 SUBSTITUTED POLYCYCLIC PYRIDONE DERIVATIVES AND PRODRUGS THEREOF SHIONOGI & CO (JP) 2024-10-03 US disclosed
EP-4434520-A1 PHARMACEUTICAL FOR TREATING HEART DISEASE OR SKELETAL MUSCLE DISEASE Shionogi & Co., Ltd. (JP) 2024-09-25 EP disclosed
US-12098151-B2 Arenavirus growth inhibitor comprising polycyclic carbamoyl pyridone derivative NATIONAL UNIVERSITY COPORATION HOKKAIDO UNIVERSITY (JP) 2024-09-24 US disclosed
WO-2006122926-A1 SUBSTITUTED AMINOPROPENYL PIPERIDINE OR MORPHOLINE DERIVATIVES AS NOVEL INHIBITORS OF HISTONE DEACETYLASE JANSSEN PHARMACEUTICA N.V. (BE) 2006-11-23 WO disclosed
WO-2006010750-A1 SUBSTITUTED INDOLYL ALKYL AMINO DERIVATIVES AS NOVEL INHIBITORS OF HISTONE DEACETYLASE JANSSEN PHARMACEUTICA N.V. (BE) 2006-02-02 WO disclosed
US-20050171347-A1 Sulfonylamino-derivatives as novel inhibitors of histone deacetylase JANSSEN PHARMACEUTICA N.V. (BE) 2005-08-04 US disclosed
EP-1549292-A2 PHARMACEUTICAL PREPARATIONS, USE OF SAID PREPARATIONS AND METHOD FOR INCREASING THE BIOAVAILABILITY OF MEDICAMENTS FOR PERORAL ADMINISTRATION Schering Aktiengesellschaft (DE) 2005-07-06 EP disclosed
US-20050113373-A1 medicine to inhibit proliferative conditions, such as cancer and psoriasis; detecting or identifying a histone deactylase (HDAC) in a biological sample JANSSEN PHARMACEUTICA N.V. (BE) 2005-05-26 US disclosed
EP-1485365-A1 SULFONYL-DERIVATIVES AS NOVEL INHIBITORS OF HISTONE DEACETYLASE JANSSEN PHARMACEUTICA N.V. (BE) 2004-12-15 EP disclosed
EP-1485354-A1 SULFONYLAMINO-DERIVATIVES AS NOVEL INHIBITORS OF HISTONE DEACETYLASE JANSSEN PHARMACEUTICA N.V. (BE) 2004-12-15 EP disclosed
WO-2004032897-A2 PHARMACEUTICAL PREPARATIONS, USE OF SAID PREPARATIONS AND METHOD FOR INCREASING THE BIOAVAILABILITY OF MEDICAMENTS FOR PERORAL ADMINISTRATION SCHERING AKTIENGESELLSCHAFT (DE) 2004-04-22 WO disclosed
WO-2003076401-A1 SULFONYLAMINO-DERIVATIVES AS NOVEL INHIBITORS OF HISTONE DEACETYLASE JANSSEN PHARMACEUTICA N.V. (BE) 2003-09-18 WO disclosed
WO-2003076422-A1 SULFONYL-DERIVATIVES AS NOVEL INHIBITORS OF HISTONE DEACETYLASE JANSSEN PHARMACEUTICA N.V. (BE) 2003-09-18 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (7 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050171347-A1 Sulfonylamino-derivatives as novel inhibitors of histone deacetylase HDAC1, HDAC3, HDAC11 AR 1042/4885SLC16A3 2007/4885MAOB 916/4885
US-20240327424-A1 SUBSTITUTED POLYCYCLIC PYRIDONE DERIVATIVES AND PRODRUGS THEREOF C3AR1, NR4A1, HAVCR2 AR 916/4885SLC16A3 1172/4885MAOB 183/4885
US-12098151-B2 Arenavirus growth inhibitor comprising polycyclic carbamoyl pyridone derivative CDK7, CCNA1, CCR10 AR 2125/4885SLC16A3 3772/4885MAOB 3019/4885
US-20050113373-A1 medicine to inhibit proliferative conditions, such as cancer and psoriasis; detecting or identifying a histone deactylase (HDAC) in a biological sample HDAC1, HDAC11, HDAC4 AR 588/4885SLC16A3 3025/4885MAOB 454/4885
US-20250257072-A1 PHARMACEUTICAL COMPOSITIONS CONTAINING SUBSTITUTED POLYCYCLIC PYRIDONE DERIVATIVES AND PRODRUG THEREOF C3AR1, CYP4B1, ADORA2B AR 1867/4885SLC16A3 1235/4885MAOB 89/4885
US-20250041279-A1 THERAPEUTIC MEDICINE FOR HEART DISEASE OR SKELETAL MUSCLE DISEASE TNNT2, CPT1B, TNNC1 AR 2471/4885SLC16A3 2929/4885MAOB 4360/4885
US-20260091022-A1 PHARMACEUTICAL COMPOSITION FOR TREATING FATTY LIVER DISEASE SLC10A1, GLP1R, SLC10A2 AR 830/4885SLC16A3 225/4885MAOB 4523/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.