SCHEMBL2479901

SCHEMBL2479901

O=C1c2ccccc2C(=O)N1[C]1CCCCC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.44
GAA P10253 2/20 0.44
KMT2A Q03164 3/20 0.44
MEN1 O00255 2/20 0.44
HPGD P15428 2/20 0.43
HSD17B10 Q99714 2/20 0.43
MAPT P10636 1/20 0.43
PKM P14618 1/20 0.43
ALOX15 P16050 1/20 0.43
ALOX12 P18054 1/20 0.43
MC4R P32245 1/20 0.43
CYP2A6 P11509 1/20 0.42
MAOA P21397 1/20 0.42
MAOB P27338 1/20 0.42
POLB P06746 1/20 0.41
HTT P42858 2/20 0.41
USP2 O75604 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
EHMT2 Q96KQ7 1/20 0.41
EHMT1 Q9H9B1 1/20 0.41

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
SCHEMBL18723155 0.70 MEN1 (0.44) ALDH1A1GAAKMT2AMEN1PKM
SCHEMBL4649471 0.69 KMT2A (0.78) ALDH1A1GAAKMT2AMEN1HTT
SCHEMBL4649466 0.69 POLB (0.65) ALDH1A1GAAKMT2AMEN1POLB
SCHEMBL31026166 0.69 CA12 (0.47) ALDH1A1GAAKMT2AHPGDHSD17B10
SCHEMBL3581991 0.67 USP2 (0.62) ALDH1A1GAAKMT2AHPGDHSD17B10
N-Phenyl-Phthalimide SCHEMBL29819622 0.67 KMT2A (0.68) ALDH1A1GAAKMT2AMEN1HPGD
SCHEMBL8723747 0.67 MEN1 (0.50) ALDH1A1GAAKMT2AMEN1MAPT
SCHEMBL19773976 0.67 KMT2A (0.68) ALDH1A1GAAKMT2AMEN1HPGD
N-Phenyl-Phthalimide SCHEMBL123618 0.67 KMT2A (0.68) ALDH1A1GAAKMT2AMEN1HPGD
SCHEMBL16296869 0.65 KMT2A (0.52) ALDH1A1KMT2AMEN1MAPTMAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2091925-A1 BICYCLIC HETEROCYCLES, MEDICAMENTS CONTAINING SAID COMPOUNDS, USE THEREOF, AND METHOD FOR PRODUCTION OF SAME Boehringer Ingelheim International GmbH (DE) 2009-08-26 EP claimed
WO-2008055854-A1 BICYCLIC HETEROCYCLES, MEDICAMENTS CONTAINING SAID COMPOUNDS, USE THEREOF, AND METHOD FOR PRODUCTION OF SAME BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2008-05-15 WO claimed
CN-109776389-A A kind of manufacturing method of the rubber anti-chark agent CTP of low value phthalimide 汤阴永新化学有限责任公司 2019-05-21 CN disclosed
EP-2373329-A2 USE OF EPIDERMAL GROWTH FACTOR INHIBITORS IN THE TREATMENT OF VIRAL INFECTION The Regents of the University of California (US) 2011-10-12 EP disclosed
WO-2010123527-A2 USE OF EPIDERMAL GROWTH FACTOR INHIBITORS IN THE TREATMENT OF VIRAL INFECTION THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2010-10-28 WO disclosed