SCHEMBL9157239

SCHEMBL9157239

Cc1cc(C)c2c(CCO)cc(=O)[nH]c2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR17 Q13304 1/20 0.47
GRIN2D O15399 3/20 0.46
GRIN3B O60391 3/20 0.46
GRIN1 Q05586 3/20 0.46
GRIN2A Q12879 3/20 0.46
GRIN2B Q13224 3/20 0.46
GRIN2C Q14957 3/20 0.46
GRIN3A Q8TCU5 3/20 0.46
KDM4E B2RXH2 3/20 0.44
POLB P06746 2/20 0.44
MAPT P10636 1/20 0.44
HSD17B10 Q99714 1/20 0.40
ERN1 O75460 1/20 0.38
JAK1 P23458 1/20 0.36
ALDH1A1 P00352 1/20 0.36
GLA P06280 1/20 0.36
GAA P10253 1/20 0.36
HPGD P15428 1/20 0.36
PKM P14618 1/20 0.36
MEN1 O00255 4/20 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
SCHEMBL9152233 0.86 KDM4E (0.42) GPR17GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL19353903 0.80 PGK1 (0.45) GPR17GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL19354163 0.79 GRIN2D (0.42) GPR17GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL9157807 0.78 KDM4E (0.46) GPR17GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL9155186 0.76 ALDH1A1 (0.45) KDM4EPOLBMAPTHSD17B10ALDH1A1
SCHEMBL6579033 0.76 GRIN2D (0.54) GPR17GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL3267595 0.75 HTR2C (0.44) GPR17GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL9152213 0.73 ALDH1A1 (0.48) KDM4EPOLBMAPTHSD17B10ALDH1A1
SCHEMBL8872158 0.69 GRIN2D (0.46) GPR17GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL28961387 0.68 GRIN2D (0.48) GPR17GRIN2DGRIN3BGRIN1GRIN2A

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