SCHEMBL9161833

SCHEMBL9161833

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

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.57
EGFR P00533 3/20 0.49
TSHR P16473 2/20 0.44
POLB P06746 2/20 0.44
LMNA P02545 1/20 0.44
HPGD P15428 1/20 0.44
NQO2 P16083 1/20 0.43
MAPT P10636 4/20 0.42
KMT2A Q03164 2/20 0.42
GAA P10253 2/20 0.42
MEN1 O00255 1/20 0.42
AHR P35869 1/20 0.41
ATM Q13315 1/20 0.41
HTR2A P28223 1/20 0.41
ALDH1A1 P00352 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
GPR84 Q9NQS5 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C19 P33261 1/20 0.40
TNKS2 Q9H2K2 1/20 0.40

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
SCHEMBL9156590 0.85 KDM4E (0.54) KDM4EEGFRTSHRPOLBLMNA
SCHEMBL9157617 0.81 DAO (0.40) KDM4ETSHRLMNAHPGDNQO2
SCHEMBL9156789 0.77 KDM4E (0.49) KDM4EEGFRTSHRPOLBLMNA
SCHEMBL19667052 0.77 NQO2 (0.67) KDM4EEGFRTSHRPOLBHPGD
SCHEMBL9766051 0.74 ALDH1A1 (0.62) KDM4ETSHRHPGDKMT2AGAA
SCHEMBL4803628 0.74 HTR2A (0.71) MAPTHTR2ASMN1; SMN2NPSR1
SCHEMBL9431360 0.72 KDM4E (0.61) KDM4EEGFRTSHRPOLBLMNA
SCHEMBL9155186 0.71 ALDH1A1 (0.45) KDM4EPOLBLMNAHPGDMAPT
SCHEMBL9152213 0.71 ALDH1A1 (0.48) KDM4ETSHRPOLBLMNAHPGD
Hydrochloric Acid SCHEMBL9432073 0.69 KDM4E (0.52) KDM4EEGFRTSHRPOLBLMNA

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