SCHEMBL3704382

SCHEMBL3704382

O=c1cccc2nncccc1-2

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 6/20 0.38
HTR2A P28223 2/20 0.35
CYP11B2 P19099 1/20 0.35
HTR2B P41595 1/20 0.35
CASP6 P55212 1/20 0.35
TDP2 O95551 1/20 0.34
NSD2 O96028 1/20 0.34
ABL1 P00519 1/20 0.34
PLCG1 P19174 1/20 0.34
CES1 P23141 1/20 0.34
PAX8 Q06710 1/20 0.34
RIN1 Q13671 1/20 0.34
MEN1 O00255 1/20 0.34
THRB P10828 1/20 0.34
BLM P54132 1/20 0.34
KMT2A Q03164 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
GAA P10253 1/20 0.34
GOT1 P17174 1/20 0.33
PRMT5 O14744 1/20 0.33

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
Hydrochloric Acid SCHEMBL8425421 0.98 HTR2C (0.37) HTR2CHTR2ACYP11B2HTR2BCASP6
Hydrochloric Acid SCHEMBL10877717 0.96 HTR2C (0.36) HTR2CHTR2ACYP11B2HTR2BCASP6
SCHEMBL20472405 0.76 CNR2 (0.47) BLMP2RX7
SCHEMBL3102409 0.75 ALDH1A1 (0.54) HTR2CHTR2ACYP11B2MEN1KMT2A
SCHEMBL29943503 0.75 ALDH1A1 (0.54) HTR2CHTR2ACYP11B2MEN1KMT2A
SCHEMBL29442588 0.74 GOT1 (0.46) HTR2CHTR2ACYP11B2HTR2BCASP6
SCHEMBL30792004 0.74 GOT1 (0.46) HTR2CHTR2ACYP11B2HTR2BCASP6
SCHEMBL1456807 0.74 GOT1 (0.46) HTR2CHTR2ACYP11B2HTR2BCASP6
SCHEMBL2482338 0.72 KDM4E (0.54) BLMKMT2ATDP1
SCHEMBL28845072 0.72 FAAH (0.41) HTR2CHTR2AHTR2BCASP6HDAC4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118355110-A Method for producing cartilage and bone 默多克儿童研究所 2024-07-16 CN claimed
WO-2023190663-A1 HIGH-PURITY COMPOUND PRODUCTION METHOD AND PURIFICATION METHOD 参天製薬株式会社 2023-10-05 WO claimed
CN-110678182-B Pharmaceutical composition containing a compound capable of penetrating the blood-brain barrier as an active ingredient for preventing or treating brain cancer 大邱庆北尖端医疗产业振兴财团 2022-08-23 CN claimed
CN-109219608-B Fused pentacyclic imidazole derivatives as modulators of TNF activity UCB生物制药私人有限公司 2021-12-21 CN claimed
CN-110678182-A Pharmaceutical composition containing a compound capable of penetrating the blood-brain barrier as an active ingredient for preventing or treating brain cancer 大邱庆北尖端医疗产业振兴财团 2020-01-10 CN claimed
EP-1100480-B1 MUSCARINIC ANTAGONISTS IN THE TREATMENT OF PRESBYOPIA ALLERGAN INC (US) 2003-09-24 EP claimed
EP-0634932-B1 METHOD FOR REDUCING INTRAOCULAR PRESSURE IN THE MAMMALIAN EYE BY ADMINISTRATION OF MUSCARINIC ANTAGONISTS ALLERGAN INC (US) 2002-06-19 EP claimed
EP-1148880-A2 METHODS FOR RESTORING AND/OR ENHANCING ACCOMMODATION IN PSEUDO PHAKIA Allergan Sales, Inc. (US) 2001-10-31 EP claimed
EP-0672666-B1 Imidazodiazepins HOFFMANN LA ROCHE (CH) 2001-07-25 EP claimed
WO-2000044379-A2 METHODS FOR RESTORING AND/OR ENHANCING ACCOMMODATION IN PSEUDO PHAKIA ALLERGAN SALES, INC. (US) 2000-08-03 WO claimed
US-5885986-A CLEAVING, N-ALKYLATING AND REDUCING THE INTERMEDIATE FORMED BY REACTING AN OXAZOLYL AND THIAZOLYLIMIDAZOBENZO AND THIENODIAZEPINE DERIVATIVES WITH AMINE COMPOUNDS; USED AS ANXIOLYTIC AND ANTICONVULSANT OR SEDATIVE-HYPNOTIC AGENTS HOFFMANN-LA ROCHE INC. (US) 1999-03-23 US claimed
US-5716952-A TOPICAL APPLICATION ALLERGAN (US) 1998-02-10 US claimed
EP-0548125-A1 SUBSTITUTED 6,7-DIHYDROIMIDAZO(1,5,4-EF)(1,5)BENZODIAZEPIN-6-ONES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS Pfizer Limited (GB) 1993-06-30 EP claimed
US-4424226-A ANTIULCER AGENTS DR. KARL THOMAE GMBH (DE) 1984-01-03 US claimed
JP-53095997-A None JP disclosed
JP-53095996-A None JP disclosed
CN-118355110-A Method for producing cartilage and bone 默多克儿童研究所 2024-07-16 CN disclosed
US-4154833-A INDOMETHACIN (1-(4-CHLOROBENZOYL)-5-METHOXY-2-METHYL-1H-INDOLE-3-ACETIC ACID) WITH PIRENZEPINE (5,11-DIHYDRO-11-((4-METHYL-1-PIPERAZINYL)-ACETYL)-6H-PYRIDO(2,3 -B)(1,4)BENZODIAZEPIN-6-ONE) BOEHRINGER INGELHEIM GMBH (DE) 1979-05-15 US disclosed
JP-S5395996-A PREPARATION OF NOVEL IMIDAZOBENZODIAZEPIN DERIVATIVES TEIJIN LTD 1978-08-22 JP disclosed
JP-S5395997-A NOVEL IMIDAZOBENZODIAZEPIN DERIVATIVES TEIJIN LTD 1978-08-22 JP disclosed