SCHEMBL6974545

SCHEMBL6974545

Cc1ccc2c(c1)C(=O)C(Br)C2

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 4/20 0.66
METAP1 P53582 4/20 0.54
HTR2A P28223 1/20 0.42
HTR2C P28335 1/20 0.42
HTR2B P41595 1/20 0.42
PARP10 Q53GL7 2/20 0.42
PARP1 P09874 1/20 0.42
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
AADAT Q8N5Z0 1/20 0.37
ELANE P08246 1/20 0.37
TP53 P04637 1/20 0.36
THRB P10828 1/20 0.36
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
CYP19A1 P11511 1/20 0.36
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA4 P22748 1/20 0.35
CA7 P43166 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
SCHEMBL6972986 0.85 METAP1 (0.54) ACHEMETAP1HTR2AHTR2CHTR2B
SCHEMBL26704102 0.82 ACHE (0.53) ACHEMETAP1PARP10PARP1MAOA
SCHEMBL24897749 0.81 ACHE (0.65) ACHEMETAP1HTR2AHTR2CHTR2B
SCHEMBL2481939 0.79 ACHE (1.00) ACHEMETAP1HTR2AHTR2CHTR2B
SCHEMBL29893908 0.79 ACHE (1.00) ACHEMETAP1HTR2AHTR2CHTR2B
SCHEMBL17675410 0.79 METAP1 (0.44) ACHEMETAP1PARP10PARP1CYP19A1
SCHEMBL6971063 0.78 ACHE (0.64) ACHEHTR2AHTR2BPARP10PARP1
SCHEMBL7847032 0.78 METAP1 (0.43) ACHEMETAP1HTR2AHTR2CHTR2B
SCHEMBL6204038 0.77 ALDH1A1 (0.42) ACHEMETAP1HTR2AHTR2CHTR2B
SCHEMBL1180262 0.77 ACHE (0.69) ACHEMETAP1HTR2AHTR2CHTR2B

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4265613-A1 BENZENE RING COMPOUND AND USE THEREOF Nanjing Shijiang Medicine Technology Co., Ltd (CN) 2023-10-25 EP disclosed
CN-1122666-C New 2,3-dioxide, indanol compounds, process for their preparation and pharmaceutical compositions containing them ADIR (FR) 2003-10-01 CN disclosed
EP-0906912-B1 Indanol derivatives, process for their preparation and pharmaceutical compositions containing them SERVIER LAB (FR) 2003-01-08 EP disclosed
US-6060487-A Indanol compounds ADIR ET COMPAGNIE (FR) 2000-05-09 US disclosed
US-5958927-A PSYCHOLOGICAL AND NERVOUS SYSTEM DISORDERS ADIR ET COMPAGNIE (FR) 1999-09-28 US disclosed
EP-0906912-A1 Indanol derivatives, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1999-04-07 EP disclosed
EP-0662971-B1 5H,10H-IMIDAZO[1,2-a]INDENO[1,2-e]PYRAZINE-4-ONE DERIVATIVES, PREPARATION THEREOF AND MEDICAMENTS CONTAINING THEM RHONE POULENC RORER SA (FR) 1998-05-13 EP disclosed
US-5677306-A ANTAGONIZING ALPHA-AMINO-3-HYDROXY-5-METHYL-4-ISOXAZOLEPROPIONIC ACID RECEPTOR, USEFUL FOR TREATING ALL ISCHEMIAS RHONE-POULENC RORER S.A. (FR) 1997-10-14 US disclosed
EP-0662971-A1 DERIVATIVES OF 5H,10H-IMIDAZO 1,2-a]INDENO 1,2-e]PYRAZINE-4-ONE, PREPARATION THEREOF AND MEDICAMENTS CONTAINING THEM Aventis Pharma S.A. (FR) 1995-07-19 EP disclosed
WO-1994007893-A1 DERIVATIVES OF 5H,10H-IMIDAZO[1,2-a]INDENO[1,2-e]PYRAZINE-4-ONE, PREPARATION THEREOF AND MEDICAMENTS CONTAINING THEM RHONE-POULENC RORER S.A. (FR) 1994-04-14 WO disclosed