SCHEMBL9156590

SCHEMBL9156590

Cc1cccc2c(CCBr)cc(=O)[nH]c12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.54
EGFR P00533 3/20 0.49
TSHR P16473 2/20 0.44
NQO2 P16083 1/20 0.43
AHR P35869 1/20 0.41
HTR2A P28223 1/20 0.41
POLB P06746 2/20 0.41
LMNA P02545 1/20 0.41
HPGD P15428 1/20 0.41
MAPT P10636 4/20 0.41
GAA P10253 2/20 0.41
ALDH1A1 P00352 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
CYP1A2 P05177 1/20 0.40
CYP2C19 P33261 1/20 0.40
TNKS2 Q9H2K2 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
KIF11 P52732 1/20 0.40
KMT2A Q03164 2/20 0.39

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
SCHEMBL9161833 0.85 KDM4E (0.57) KDM4EEGFRTSHRNQO2AHR
SCHEMBL9158309 0.81 DAO (0.38) KDM4EEGFRTSHRNQO2HPGD
SCHEMBL19667052 0.77 NQO2 (0.67) KDM4EEGFRTSHRNQO2AHR
SCHEMBL9156789 0.74 KDM4E (0.49) KDM4EEGFRTSHRNQO2POLB
SCHEMBL9154966 0.74 ALDH1A1 (0.56) KDM4ETSHRHPGDGAAALDH1A1
SCHEMBL9431360 0.72 KDM4E (0.61) KDM4EEGFRTSHRNQO2AHR
SCHEMBL9153152 0.71 LMNA (0.42) KDM4EHTR2APOLBLMNAHPGD
SCHEMBL9157725 0.71 ALDH1A1 (0.46) KDM4ETSHRHTR2APOLBLMNA
SCHEMBL4119112 0.69 KDM4E (0.55) KDM4EHTR2AMAPTCYP2C19
SCHEMBL3949025 0.69 NOS2 (0.51) CYP1A2CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5457099-A Carbostyril derivatives and antiallergic agent SAWAI PHARMACEUTICAL CO., LTD. (JP) 1995-10-10 US disclosed
EP-0577325-A1 Carbostyril derivatives and antiallergic agent SAWAI PHARMACEUTICAL CO., LTD. (JP) 1994-01-05 EP disclosed