SCHEMBL5655604

SCHEMBL5655604

NNC(=O)c1nccc2ccccc12

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.62
HDAC3 O15379 2/20 0.55
HDAC4 P56524 2/20 0.55
HDAC1 Q13547 2/20 0.55
HDAC7 Q8WUI4 2/20 0.55
HDAC2 Q92769 2/20 0.55
HDAC10 Q969S8 2/20 0.55
HDAC11 Q96DB2 2/20 0.55
HDAC8 Q9BY41 2/20 0.55
HDAC6 Q9UBN7 2/20 0.55
HDAC9 Q9UKV0 2/20 0.55
HDAC5 Q9UQL6 2/20 0.55
CNR2 P34972 5/20 0.52
MAPT P10636 3/20 0.51
MEN1 O00255 1/20 0.51
TP53 P04637 1/20 0.51
TSHR P16473 1/20 0.51
KMT2A Q03164 1/20 0.51
KDM4E B2RXH2 2/20 0.49
ALDH1A1 P00352 2/20 0.49

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
SCHEMBL28283137 0.87 RAB9A (0.54) RAB9AHDAC3HDAC4HDAC1HDAC7
SCHEMBL2230478 0.84 RAB9A (0.60) RAB9AHDAC3HDAC4HDAC1HDAC7
SCHEMBL25474761 0.83 RAB9A (0.58) RAB9AHDAC3HDAC4HDAC1HDAC7
SCHEMBL30956107 0.83 RAB9A (0.58) RAB9AHDAC3HDAC4HDAC1HDAC7
SCHEMBL13306750 0.83 RAB9A (0.58) RAB9AHDAC3HDAC4HDAC1HDAC7
SCHEMBL8617844 0.82 RAB9A (0.55) RAB9AHDAC3HDAC4HDAC1HDAC7
SCHEMBL24898159 0.82 RAB9A (0.66) RAB9AHDAC3HDAC4HDAC1HDAC7
SCHEMBL4097649 0.82 RAB9A (0.61) RAB9AHDAC3HDAC4HDAC1HDAC7
SCHEMBL1207770 0.81 RAB9A (0.68) RAB9AHDAC3HDAC4HDAC1HDAC7
SCHEMBL8790412 0.81 RAB9A (0.77) RAB9AMAPTMEN1TP53TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116444430-A Off-on near infrared lead ion detection fluorescent probe YSQ and preparation method and application thereof 江苏科技大学 2023-07-18 CN claimed
CN-113637004-B Aluminum ion detection fluorescent probe based on bifunctional small organic molecule as matrix, and preparation method and application thereof 江苏科技大学 2022-09-23 CN claimed
CN-114790200-A Fluorescence-enhanced zinc ion detection fluorescent probe ENO and preparation method and application thereof 江苏科技大学 2022-07-26 CN claimed
CN-110590756-B Phenolphthalein Schiff base fluorescent probe and preparation method and application thereof 南通大学 2022-04-22 CN claimed
CN-113307801-B Phenolphthalein quinoline Al3+Preparation method and application of fluorescent probe 南通大学 2022-04-22 CN claimed
CN-113637004-A Aluminum ion detection fluorescent probe based on dual-functional organic micromolecule as matrix and preparation method and application thereof 江苏科技大学 2021-11-12 CN claimed
CN-113307801-A Phenolphthalein quinoline Al3+Preparation method and application of fluorescent probe 南通大学 2021-08-27 CN claimed
CN-110590756-A Phenolphthalein Schiff base fluorescent probe and preparation method and application thereof 南通大学 2019-12-20 CN claimed
CN-116444430-B Off-on near infrared lead ion detection fluorescent probe YSQ and preparation method and application thereof 江苏科技大学 2026-01-30 CN disclosed
CN-118955323-A Used for Al3+Naphthalene schiff base fluorescent probe for detection, preparation method and application 西安石油大学 2024-11-15 CN disclosed
US-12018012-B2 Aryl cyclopropyl-amino-isoquinolinyl amide compounds AERIE PHARMACEUTICALS, INC. (US) 2024-06-25 US disclosed
US-11891376-B2 Aryl cyclopropyl-amino-isoquinolinyl amide compounds AERIE PHARMACEUTICALS, INC. (US) 2024-02-06 US disclosed
CN-114790200-B Fluorescence enhancement type zinc ion detection fluorescent probe ENO, and preparation method and application thereof 江苏科技大学 2023-11-24 CN disclosed
CN-114790200-B Fluorescence enhancement type zinc ion detection fluorescent probe ENO, and preparation method and application thereof 江苏科技大学 2023-11-24 CN disclosed
EP-1320523-B1 BRANCHED CHAIN AMINO ACID-DEPENDENT AMINOTRANSFERASE INHIBITORS AND THEIR USE IN THE TREATMENT OF NEURODEGENERATIVE DISEASES WARNER LAMBERT CO (US) 2005-06-22 EP disclosed
US-20050004167-A1 Branched chain amino acid-dependent aminotransferase inhibitors and their use in the treatment of neurodegenerative diseases WARNER-LAMBERT COMPANY LLC 2005-01-06 US disclosed
US-20040157865-A1 Naphthol, quinoline and isoquinoline-derived urea modulators of vanilloid VR1 receptor JANSSEN PHARMACEUTICA, N.V. (BE) 2004-08-12 US disclosed
WO-2004007459-A2 NAPHTHOL, QUINOLINE AND ISOQUINOLINE-DERIVATIVES AS MODULATORS OF VANILLOID VR1 RECEPTOR JANSSEN PHARMACEUTICA N.V. (BE) 2004-01-22 WO disclosed
EP-1320523-A2 BRANCHED CHAIN AMINO ACID-DEPENDENT AMINOTRANSFERASE INHIBITORS AND THEIR USE IN THE TREATMENT OF NEURODEGENERATIVE DISEASES Warner-Lambert Company LLC (US) 2003-06-25 EP disclosed
WO-2002024672-A2 BRANCHED CHAIN AMINO ACID-DEPENDENT AMINOTRANSFERASE INHIBITORS AND THEIR USE IN THE TREATMENT OF NEURODEGENERATIVE DISEASES WARNER-LAMBERT COMPANY LLC (US) 2002-03-28 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 (4 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-20050004167-A1 Branched chain amino acid-dependent aminotransferase inhibitors and their use in the treatment of neurodegenerative diseases BCAT1, BCAT2, ABAT RAB9A 2547/4885HDAC3 2570/4885HDAC4 3534/4885
US-12018012-B2 Aryl cyclopropyl-amino-isoquinolinyl amide compounds UACA, HRAS, MYLK RAB9A 541/4885HDAC3 1188/4885HDAC4 1635/4885
US-11891376-B2 Aryl cyclopropyl-amino-isoquinolinyl amide compounds UACA, CHUK, MAP3K2 RAB9A 992/4885HDAC3 1221/4885HDAC4 1251/4885
US-20040157865-A1 Naphthol, quinoline and isoquinoline-derived urea modulators of vanilloid VR1 receptor OPRL1, VRK1, OPRK1 RAB9A 3596/4885HDAC3 3691/4885HDAC4 3041/4885

“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.