SCHEMBL17794568

SCHEMBL17794568

CC1CNc2cc(C#N)c(-c3cnn(C)c3)cc2C1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ USP30 Q70CQ3 1/20 0.43
▸ RET P07949 8/20 0.38
▸ CNR1 P21554 1/20 0.35
▸ CNR2 P34972 1/20 0.35
▸ PIK3CD O00329 3/20 0.34
▸ FGFR3 P22607 1/20 0.34
▸ HCRTR1 O43613 1/20 0.34
▸ HCRTR2 O43614 1/20 0.34
▸ LRRK2 Q5S007 2/20 0.34
▸ BRD4 O60885 1/20 0.34
▸ CREBBP Q92793 1/20 0.34
▸ PIK3CG P48736 1/20 0.34
▸ OTUD7B Q6GQQ9 1/20 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
SCHEMBL17785736 0.81 USP30 (0.46) USP30RETCNR1CNR2LRRK2
SCHEMBL29471152 0.79 USP30 (0.41) USP30RETCNR1CNR2PIK3CD
SCHEMBL17799507 0.79 USP30 (0.41) USP30RETCNR1CNR2PIK3CD
SCHEMBL31601615 0.79 USP30 (0.45) USP30RETCNR1CNR2LRRK2
SCHEMBL17809788 0.78 USP30 (0.51) USP30CNR1CNR2PIK3CDFGFR3
SCHEMBL17809794 0.78 USP30 (0.51) USP30CNR1CNR2PIK3CDFGFR3
SCHEMBL17809580 0.78 USP30 (0.51) USP30CNR1CNR2PIK3CDFGFR3
SCHEMBL17806328 0.74 USP30 (0.48) USP30RETCNR1CNR2PIK3CD
SCHEMBL17806392 0.74 USP30 (0.48) USP30RETCNR1CNR2PIK3CD
SCHEMBL17806364 0.74 USP30 (0.48) USP30RETCNR1CNR2PIK3CD

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
WO-2016086200-A9 4,5,6,7-TETRAHYDRO-1 H-PYRAZOLO[4,3-C]PYRIDIN-3-AMINE COMPOUNDS AS CBP AND/OR EP300 INHIBITORS GENENTECH, INC. (US) 2016-06-23 — — WO disclosed
WO-2016086200-A1 4,5,6,7-TETRAHYDRO-1 H-PYRAZOLO[4,3-C]PYRIDIN-3-AMINE COMPOUNDS AS CBP AND/OR EP300 INHIBITORS GENENTECH, INC. (US) 2016-06-02 — — WO disclosed
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