SCHEMBL9844697

SCHEMBL9844697

Cc1ccc2cc3n(c2c1)CCC3=O

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SRD5A1 P18405 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
RPS6KA2 Q15349 4/20 0.36
RPS6KA3 P51812 1/20 0.35
HSD17B10 Q99714 1/20 0.35
ALDH1A1 P00352 1/20 0.35
CYP1A2 P05177 2/20 0.34
CYP2A6 P11509 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
MAPT P10636 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34
NOTUM Q6P988 1/20 0.34
KDM4E B2RXH2 1/20 0.34
ALOX5 P09917 2/20 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
SCHEMBL9259274 0.87 KDM4E (0.39) SRD5A1SMN1; SMN2HSD17B10ALDH1A1CYP1A2
SCHEMBL9261555 0.80 HTR2A (0.49) SRD5A1SMN1; SMN2RPS6KA2HSD17B10ALDH1A1
SCHEMBL9259549 0.77 HTR2A (0.44) RPS6KA3L3MBTL1NOTUM
SCHEMBL9735949 0.70 HTR2A (0.45) SRD5A1HSD17B10ALDH1A1MAPTKDM4E
SCHEMBL9264795 0.70 KDM4E (0.56) SRD5A1SMN1; SMN2HSD17B10ALDH1A1L3MBTL1
SCHEMBL9736283 0.70 SRD5A1 (0.40) SRD5A1SMN1; SMN2HSD17B10ALDH1A1CYP1A2
SCHEMBL3083411 0.69 RPS6KA3 (0.52) RPS6KA2RPS6KA3ALDH1A1CYP1A2
SCHEMBL9279188 0.69 ALOX5 (0.37) HSD17B10ALDH1A1CYP1A2CYP2A6MAPT
SCHEMBL9387355 0.68 HTR2A (0.41) RPS6KA2RPS6KA3HSD17B10ALDH1A1CYP1A2
SCHEMBL13618587 0.68 PABPC1 (0.49) SMN1; SMN2HSD17B10ALDH1A1CYP1A2L3MBTL1

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
EP-0441517-A2 Tricyclic amines as novel cholinesterase inhibitors PFIZER INC. (US) 1991-08-14 EP disclosed