SCHEMBL9259282

SCHEMBL9259282

Cc1ccc2cc3n(c2c1)C(=O)CC3

nearest known ligand 0.62

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.62
HSD17B10 Q99714 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
TSHR P16473 1/20 0.36
CYP1A2 P05177 2/20 0.35
CYP2A6 P11509 2/20 0.35
MAPT P10636 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35
SRD5A1 P18405 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.34
CYP19A1 P11511 2/20 0.33
DAO P14920 1/20 0.33
ALDH1A1 P00352 2/20 0.33
KDM4E B2RXH2 2/20 0.33
POLB P06746 1/20 0.33
CA12 O43570 2/20 0.33
CA9 Q16790 2/20 0.33
PLA2G10 O15496 1/20 0.32

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
SCHEMBL9844702 0.86 NOTUM (0.62) NOTUMHSD17B10L3MBTL1TSHRCYP1A2
SCHEMBL9844700 0.79 NOTUM (0.62) NOTUMHSD17B10CYP1A2CYP2A6SRD5A1
SCHEMBL9735956 0.79 NOTUM (0.62) NOTUMHSD17B10MAPTSRD5A1CYP19A1
SCHEMBL9264812 0.79 NOTUM (0.57) NOTUMHSD17B10CYP1A2CYP2A6MAPT
SCHEMBL9736291 0.79 NOTUM (0.57) NOTUML3MBTL1CYP1A2CYP2A6MAPT
SCHEMBL30615209 0.77 NOTUM (1.00) NOTUMTSHRMAPTDAOALDH1A1
SCHEMBL9259627 0.77 NOTUM (1.00) NOTUMTSHRMAPTDAOALDH1A1
SCHEMBL9844699 0.75 NOTUM (0.53) NOTUMHSD17B10TSHRCYP1A2MAPT
SCHEMBL24329594 0.70 SMN1; SMN2 (0.44) NOTUMHSD17B10L3MBTL1TSHRMAPT
SCHEMBL9261564 0.69 NOTUM (0.57) NOTUMHSD17B10L3MBTL1CYP1A2CYP2A6

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
US-5428043-A Tricyclic-cyclic amines as novel cholinesterase inhibitors PFIZER INC. (US) 1995-06-27 US disclosed
EP-0441517-A2 Tricyclic amines as novel cholinesterase inhibitors PFIZER INC. (US) 1991-08-14 EP disclosed