SCHEMBL186350

SCHEMBL186350

O=C1[CH]c2ccccc2C1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.46
CYP2A6 P11509 1/20 0.44
MAOA P21397 3/20 0.42
MAOB P27338 2/20 0.42
TRPA1 O75762 1/20 0.39
CES1 P23141 2/20 0.38
BCHE P06276 1/20 0.38
TSHR P16473 2/20 0.38
AHR P35869 1/20 0.37
PDK2 Q15119 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37
ACHE P22303 1/20 0.37
ANPEP P15144 4/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
USP2 O75604 1/20 0.35
ALDH1A1 P00352 1/20 0.35
HPN P05981 1/20 0.35
CYP3A4 P08684 1/20 0.35
ALOX5 P09917 1/20 0.35

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
SCHEMBL2235621 0.78 TRPA1 (0.50) CYP1A2MAOAMAOBTRPA1TSHR
SCHEMBL29421729 0.78 GSK3A (0.46) CYP1A2CYP2A6MAOAMAOBTRPA1
SCHEMBL232478 0.78 CYP2A6 (0.48) CYP1A2CYP2A6MAOAMAOBCES1
SCHEMBL461295 0.78 GSK3A (0.46) CYP1A2CYP2A6MAOAMAOBTRPA1
Hydrochloric Acid SCHEMBL8917627 0.76 GSK3A (0.43) CYP1A2CYP2A6MAOAMAOBTRPA1
SCHEMBL3106328 0.76 GSK3A (0.43) CYP1A2CYP2A6MAOAMAOBTRPA1
SCHEMBL3102143 0.76 GSK3A (0.43) CYP1A2CYP2A6MAOAMAOBTRPA1
SCHEMBL3107446 0.76 GSK3A (0.43) CYP1A2CYP2A6MAOAMAOBTRPA1
SCHEMBL30579936 0.76 GSK3A (0.43) CYP1A2CYP2A6MAOAMAOBTRPA1
SCHEMBL6517663 0.73 GSK3A (0.40) CYP1A2CYP2A6MAOAMAOBTRPA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116234546-A GPX4 inhibitors, pharmaceutical compositions thereof and their use in the treatment of GPX4 mediated diseases 嘉兴优博生物技术有限公司 2023-06-06 CN claimed
WO-2021183702-A1 GPX4 INHIBITORS, PHARMACEUTICAL COMPOSITIONS THEREOF, AND THEIR USE FOR TREATING GPX4-MEDIATED DISEASES EUBULUS BIOTHERAPEUTICS INC. (CN) 2021-09-16 WO claimed
WO-2020207352-A1 TRIAZINE BENZIMIDAZOLE COMPOUNDS AND MEDICAL USE THEREOF 四川科伦博泰生物医药股份有限公司 2020-10-15 WO claimed
EP-4387613-A1 CONJUGATES OF MONOCYCLIC BETA-LACTAMS AND SIDEROPHORE MIMETICS University of Notre Dame du Lac (US) 2024-06-26 EP disclosed
US-20240190817-A1 METHODS OF TREATING CANCER INSTITUTE FOR CANCER RES D/B/A THE RES INSTITUTE OF FOX CHASE CANCER CENTER (US) 2024-06-13 US disclosed
EP-4373832-A1 PROCESSES OF MAKING ONAPRISTONE AND INTERMEDIATES THEREOF Context Biopharma Inc. (US) 2024-05-29 EP disclosed
US-20240165077-A1 COMPOSITIONS AND METHODS FOR TREATING NEUROLOGIC DISEASES COGNITION THERAPEUTICS, INC. (US) 2024-05-23 US disclosed
US-11981636-B2 Compositions for treating neurodegenerative diseases COGNITION THERAPEUTICS, INC. (US) 2024-05-14 US disclosed
US-20240150288-A1 ISOINDOLINE COMPOSITIONS AND METHODS FOR TREATING NEURODEGENERATIVE DISEASE COGNITION THERAPEUTICS, INC. (US) 2024-05-09 US disclosed
US-20240139188-A1 Arylamide Compounds For Treatment And Prevention Of Fungal Infections INNOVATION PHARMACEUTICALS INC (US) 2024-05-02 US disclosed
US-11964961-B2 Heteroaromatic compounds and their use as dopamine D1 ligands PFIZER INC. (US) 2024-04-23 US disclosed
US-RE37556-E1 (ALKOXYPHENYL)THIAZOLE DERIVATIVES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2002-02-19 US disclosed
EP-1130017-A2 Azole derivatives and their use as superoxide radical inhibitors OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2001-09-05 EP disclosed
US-6080764-A PROTECTING VARIOUS TISSUE CELLS FROM DISTURBANCES ASSOCIATED WITH ISCHEMIA AND BLOOD REPERFUSION IN HEART, BRAIN, KIDNEY, LUNG AND DIGESTIVE TRACT BY INHIBITING SUPEROXIDE-RELEASE BY NEUTROPHILIC LEUKOCYTES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2000-06-27 US disclosed
EP-0934937-A1 Azole derivatives as superoxide radical inhibitor OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1999-08-11 EP disclosed
US-5677319-A THIAZOLE DERIVATIVE OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1997-10-14 US disclosed
US-5643932-A PREVENTS CELL DAMAGE AFTER ISCHEMIA AND RE-PERFUSION, SUBSTITUTED THIAZOLES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1997-07-01 US disclosed
US-5262440-A Treatment of neoplasms ELI LILLY AND COMPANY (US) 1993-11-16 US disclosed
US-5254582-A Using n-((3,4-dichlorophenyl)amino)carbonyl)-2,3-dihydro-benzofuran-5-sulfonamide ELI LILLY AND COMPANY (US) 1993-10-19 US disclosed
EP-0513387-A1 ACTIVE OXYGEN INHIBITOR OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1992-11-19 EP 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 (6 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-20240150288-A1 ISOINDOLINE COMPOSITIONS AND METHODS FOR TREATING NEURODEGENERATIVE DISEASE TMEM97, SLC18A2, PSD CYP1A2 3107/4885CYP2A6 4616/4885MAOA 2004/4885
US-11964961-B2 Heteroaromatic compounds and their use as dopamine D1 ligands DRD2, DRD1, HTR1D CYP1A2 1630/4885CYP2A6 1495/4885MAOA 177/4885
US-20240190817-A1 METHODS OF TREATING CANCER MGMT, BRCA1, EP300 CYP1A2 4479/4885CYP2A6 3311/4885MAOA 2362/4885
US-11981636-B2 Compositions for treating neurodegenerative diseases HTT, RTN3, RB1 CYP1A2 3551/4885CYP2A6 2386/4885MAOA 2129/4885
US-20240139188-A1 Arylamide Compounds For Treatment And Prevention Of Fungal Infections NAT1, ERG28, AADAC CYP1A2 191/4885CYP2A6 265/4885MAOA 302/4885
US-20240165077-A1 COMPOSITIONS AND METHODS FOR TREATING NEUROLOGIC DISEASES SNCA, ACHE, PARK7 CYP1A2 3649/4885CYP2A6 3407/4885MAOA 104/4885

“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.