SCHEMBL17785717

SCHEMBL17785717

Cc1n[nH]cc1-c1ccc2c(c1)NCC2

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 2/20 0.41
▸ JAK3 P52333 2/20 0.41
▸ S1PR1 P21453 1/20 0.40
▸ GFER P55789 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ PARP10 Q53GL7 3/20 0.36
▸ PARP1 P09874 1/20 0.36
▸ CDK9 P50750 1/20 0.35
▸ PARP11 Q9NR21 2/20 0.33
▸ DRD2 P14416 1/20 0.33
▸ DRD4 P21917 1/20 0.33
▸ CD274 Q9NZQ7 3/20 0.32
▸ MAPKAPK2 P49137 1/20 0.32
▸ OPRM1 P35372 1/20 0.32
▸ OPRL1 P41146 1/20 0.32
▸ BRD4 O60885 1/20 0.31
▸ SYK P43405 1/20 0.31
▸ AURKB Q96GD4 1/20 0.31
▸ INCENP Q9NQS7 1/20 0.31

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
SCHEMBL1011843 0.75 MAOA (0.43) DRD2DRD4
SCHEMBL27993444 0.74 CD274 (0.51) GFERSMN1; SMN2PARP10PARP1PARP11
SCHEMBL13229352 0.74 JAK2 (0.46) JAK2JAK3S1PR1GFERSMN1; SMN2
SCHEMBL1011538 0.72 MAOA (0.43) DRD2DRD4CD274
SCHEMBL17785738 0.72 DRD1 (0.30) —
SCHEMBL17785674 0.72 AR (0.32) —
SCHEMBL13229310 0.72 JAK2 (0.42) JAK2JAK3S1PR1GFERSMN1; SMN2
SCHEMBL10922053 0.71 CHEK1 (0.50) CD274
SCHEMBL28536202 0.70 S1PR1 (0.53) JAK2JAK3S1PR1GFERSMN1; SMN2
SCHEMBL2685244 0.69 PDE3B (0.47) JAK2JAK3S1PR1GFERSMN1; SMN2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3224258-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) 2017-10-04 — — EP disclosed
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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