SCHEMBL7516627

SCHEMBL7516627

Cc1ccc(OCCCc2oc(-c3c[nH]c(C)n3)nc2-c2ccc(Cl)cc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.39
DRD4 P21917 1/20 0.39
DRD3 P35462 1/20 0.39
KCNH2 Q12809 3/20 0.37
PPARG P37231 1/20 0.36
PPARA Q07869 1/20 0.36
RXFP1 Q9HBX9 2/20 0.36
TDP1 Q9NUW8 3/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
KMT2A Q03164 1/20 0.35
TP53 P04637 1/20 0.35
MAPT P10636 1/20 0.34
AGER Q15109 3/20 0.34
CXCR1 P25024 2/20 0.34
THRB P10828 1/20 0.33

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
SCHEMBL4442467 0.93 MAPT (0.38) KCNH2TDP1L3MBTL1SMN1; SMN2MEN1
SCHEMBL7507160 0.92 TDP1 (0.44) DRD2DRD4DRD3KCNH2RXFP1
SCHEMBL7509782 0.91 TDP1 (0.41) DRD2DRD4DRD3KCNH2PPARG
SCHEMBL7511397 0.90 PTPN1 (0.41) DRD2KCNH2PPARGPPARASMN1; SMN2
SCHEMBL7509113 0.90 KCNH2 (0.34) KCNH2TDP1L3MBTL1SMN1; SMN2MAPT
SCHEMBL7508031 0.89 HSD17B10 (0.39) KCNH2PPARGPPARATDP1L3MBTL1
SCHEMBL7514067 0.88 MAPT (0.36) KCNH2PPARGPPARATDP1L3MBTL1
SCHEMBL7508005 0.87 HTR1A (0.33) KCNH2PPARGPPARATDP1L3MBTL1
SCHEMBL7512113 0.86 CETP (0.32) TDP1
SCHEMBL4440984 0.86 POLB (0.40) KCNH2RXFP1TDP1L3MBTL1SMN1; SMN2

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
EP-1206472-A1 OXAZOLE AND THIAZOLE DERIVATIVES AS NEUROTROPHIN PRODUCTION/SECRETION PROMOTING AGENT Takeda Chemical Industries, Ltd. (JP) 2002-05-22 EP disclosed
WO-2001014372-A2 OXAZOLE AND THIAZOLE DERIVATIVES AS NEUROTROPHIN PRODUCTION/SECRETION PROMOTING AGENT TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-03-01 WO disclosed