SCHEMBL9586148

SCHEMBL9586148

Clc1ccc(-n2nnc3ccccc32)c(Cl)c1Cl

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNMA1 Q12791 1/20 0.54
RAB9A P51151 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.43
ALDH1A1 P00352 3/20 0.42
NPSR1 Q6W5P4 1/20 0.42
KMT2A Q03164 3/20 0.42
SLC9A1 P19634 4/20 0.42
MAPT P10636 2/20 0.42
POLB P06746 2/20 0.42
MAPK1 P28482 1/20 0.42
ATM Q13315 1/20 0.42
KEAP1 Q14145 1/20 0.42
MGAM O43451 1/20 0.42
AMY1A P0DUB6 1/20 0.42
GAA P10253 1/20 0.42
SI P14410 1/20 0.42
MGAM2 Q2M2H8 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2D6 P10635 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
SCHEMBL23840194 0.84 KCNMA1 (0.64) KCNMA1RAB9ASMN1; SMN2ALDH1A1NPSR1
SCHEMBL24179294 0.78 KCNMA1 (0.55) KCNMA1RAB9ASMN1; SMN2ALDH1A1NPSR1
SCHEMBL20428912 0.75 KCNMA1 (0.46) KCNMA1RAB9ASMN1; SMN2ALDH1A1KMT2A
SCHEMBL20821940 0.75 KCNMA1 (0.46) KCNMA1RAB9ASMN1; SMN2ALDH1A1KMT2A
SCHEMBL25021088 0.74 KCNMA1 (0.55) KCNMA1RAB9ASMN1; SMN2ALDH1A1NPSR1
SCHEMBL8844809 0.74 KCNMA1 (0.55) KCNMA1RAB9ASMN1; SMN2ALDH1A1NPSR1
SCHEMBL22767716 0.73 KCNMA1 (0.47) KCNMA1RAB9ASMN1; SMN2ALDH1A1NPSR1
SCHEMBL24179215 0.71 KCNMA1 (0.48) KCNMA1RAB9ASMN1; SMN2ALDH1A1NPSR1
SCHEMBL4209963 0.70 KCNMA1 (0.64) KCNMA1RAB9ASMN1; SMN2ALDH1A1KMT2A
SCHEMBL80393 0.70 KCNMA1 (1.00) KCNMA1RAB9ASMN1; SMN2ALDH1A1KMT2A

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
US-5254552-A Cognition activators, psychological disorders AMERICAN HOME PRODUCTS CORPORATION (US) 1993-10-19 US disclosed