SCHEMBL28790489

SCHEMBL28790489

COc1c[nH]cc1CN1CCOCC1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 1/20 0.48
▸ SMN1; SMN2 Q16637 2/20 0.47
▸ DRD2 P14416 1/20 0.46
▸ DRD4 P21917 1/20 0.46
▸ HRH2 P25021 1/20 0.46
▸ HRH1 P35367 1/20 0.46
▸ DRD3 P35462 1/20 0.46
▸ CYP2A13 Q16696 2/20 0.45
▸ HSD17B10 Q99714 2/20 0.45
▸ CYP2C9 P11712 1/20 0.45
▸ ALOX15 P16050 1/20 0.45
▸ SYK P43405 1/20 0.44
▸ CYP2D6 P10635 1/20 0.44
▸ TSHR P16473 1/20 0.44
▸ ALDH1A1 P00352 4/20 0.44
▸ KDM4E B2RXH2 3/20 0.43
▸ MAPT P10636 2/20 0.43
▸ LMNA P02545 1/20 0.43
▸ RECQL P46063 1/20 0.43
▸ GAA P10253 1/20 0.42

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
SCHEMBL14132099 0.78 CYP2A13 (0.57) CYP2A13HSD17B10CYP2C9ALOX15ALDH1A1
SCHEMBL14514792 0.75 CYP2A13 (0.63) DRD2DRD4HRH2HRH1DRD3
SCHEMBL260363 0.75 CYP2C9 (0.53) HTTCYP2A13HSD17B10CYP2C9ALOX15
SCHEMBL10782490 0.74 CYP2A13 (0.61) DRD2DRD4HRH2HRH1DRD3
SCHEMBL12683586 0.73 LMNA (0.53) HTTSMN1; SMN2DRD2DRD4HRH2
SCHEMBL13726528 0.73 MEN1 (0.72) HTTSMN1; SMN2DRD2DRD4HRH2
SCHEMBL11225310 0.73 CHRM2 (0.63) HTTSMN1; SMN2DRD2HRH1DRD3
SCHEMBL21587706 0.72 KDM4E (0.64) HTTSMN1; SMN2TSHRALDH1A1KDM4E
SCHEMBL260803 0.71 CYP2C9 (0.45) CYP2A13HSD17B10CYP2C9ALOX15KDM4E
SCHEMBL10894451 0.71 CYP2D6 (0.62) DRD2DRD4HRH2HRH1DRD3

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
CN-101987848-B New dihydroindolone derivatives, method of preparing same and pharmaceutical compositions containing the same SERVIER LAB 2014-06-18 — — CN disclosed
CN-101987848-A New dihydroindolone derivatives, method of preparing same and pharmaceutical compositions containing them SERVIER LAB 2011-03-23 — — CN disclosed
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