SCHEMBL9732575

SCHEMBL9732575

COc1cc2c(C=O)cn(Cc3ccccc3)c2cc1Cl

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.49
SMN1; SMN2 Q16637 6/20 0.49
KMT2A Q03164 6/20 0.49
LMNA P02545 4/20 0.49
MEN1 O00255 4/20 0.49
TDP1 Q9NUW8 2/20 0.47
HTT P42858 3/20 0.47
PLA2G2A P14555 1/20 0.47
MAPT P10636 5/20 0.46
TP53 P04637 1/20 0.46
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
KDM4E B2RXH2 2/20 0.44
NTSR1 P30989 1/20 0.44
GPR55 Q9Y2T6 1/20 0.44
POLB P06746 1/20 0.43
GAA P10253 1/20 0.43
NPSR1 Q6W5P4 1/20 0.42
P2RX7 Q99572 2/20 0.41
APP P05067 1/20 0.41

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
SCHEMBL9732936 0.91 MAPT (0.54) ALDH1A1SMN1; SMN2KMT2ALMNAMEN1
SCHEMBL9732943 0.88 ALDH1A1 (0.47) ALDH1A1SMN1; SMN2KMT2ALMNAMEN1
SCHEMBL9733238 0.87 ALDH1A1 (0.52) ALDH1A1SMN1; SMN2KMT2ALMNAMEN1
SCHEMBL13621802 0.81 ALDH1A1 (0.60) ALDH1A1SMN1; SMN2KMT2ALMNAMEN1
SCHEMBL9584018 0.80 PLA2G2A (0.61) ALDH1A1LMNAPLA2G2A
SCHEMBL17829679 0.77 ALDH1A1 (0.57) ALDH1A1SMN1; SMN2KMT2ALMNAMEN1
SCHEMBL17829696 0.77 ALDH1A1 (0.60) ALDH1A1SMN1; SMN2KMT2ALMNAMEN1
SCHEMBL29377589 0.74 ALDH1A1 (0.78) ALDH1A1SMN1; SMN2KMT2ALMNAMEN1
SCHEMBL1418988 0.74 ALDH1A1 (0.78) ALDH1A1SMN1; SMN2KMT2ALMNAMEN1
SCHEMBL28480601 0.74 TDP1 (0.58) ALDH1A1SMN1; SMN2KMT2ALMNAMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1992007829-A1 INDOLE-3-METHANAMINES USEFUL AS ANTI-DIABETIC, ANTI-OBESITY AND ANTI-ATHEROSCLEROTIC AGENTS THE UPJOHN COMPANY (US) 1992-05-14 WO disclosed