SCHEMBL17794574

SCHEMBL17794574

Cc1c(-c2cc3c(cc2C(F)F)NCC3)cnn1C

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ AR P10275 1/20 0.33
▸ CYP11B2 P19099 1/20 0.33
▸ ATR Q13535 1/20 0.32
▸ ATRIP Q8WXE1 1/20 0.32
▸ CREBBP Q92793 6/20 0.32
▸ P4HB P07237 1/20 0.32
▸ BRD4 O60885 4/20 0.31
▸ IDH1 O75874 1/20 0.31
▸ EP300 Q09472 1/20 0.30

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
SCHEMBL17785657 0.79 CREBBP (0.47) CREBBPBRD4EP300
SCHEMBL17795493 0.76 CREBBP (0.39) CREBBPBRD4EP300
SCHEMBL17785674 0.74 AR (0.32) ARP4HB
SCHEMBL17809750 0.74 CREBBP (0.44) CREBBPBRD4EP300
SCHEMBL17785618 0.74 CYP11B2 (0.48) CYP11B2CREBBPBRD4
SCHEMBL17806369 0.73 CREBBP (0.37) CREBBPBRD4EP300
SCHEMBL19368863 0.72 CREBBP (0.39) CREBBPBRD4EP300
SCHEMBL17785637 0.72 CREBBP (0.50) CREBBPBRD4EP300
SCHEMBL29403112 0.72 CREBBP (0.50) CREBBPBRD4EP300
SCHEMBL17806365 0.71 CREBBP (0.42) CREBBPBRD4EP300

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-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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