SCHEMBL19657334

SCHEMBL19657334

Bc1ccc2c(c1)CN(C(=O)NC)CCN2

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GPR142 Q7Z601 1/20 0.44
CREBBP Q92793 9/20 0.43
AHR P35869 2/20 0.42
MAPK1 P28482 1/20 0.41
HPGD P15428 1/20 0.37
BAZ2B Q9UIF8 2/20 0.36
POLB P06746 1/20 0.35
F12 P00748 3/20 0.34
F2 P00734 1/20 0.34

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
SCHEMBL19657532 0.85 CREBBP (0.46) GPR142CREBBPAHRMAPK1HPGD
SCHEMBL19657539 0.84 GPR142 (0.44) GPR142CREBBPAHRMAPK1HPGD
SCHEMBL19643592 0.84 BAZ2B (0.48) GPR142CREBBPAHRMAPK1HPGD
SCHEMBL22822708 0.82 CREBBP (0.46) GPR142CREBBPAHRMAPK1HPGD
SCHEMBL19644152 0.81 MAPK1 (0.61) GPR142CREBBPAHRMAPK1HPGD
SCHEMBL7563761 0.70 MAPK1 (0.45) GPR142CREBBPAHRMAPK1HPGD
SCHEMBL15522980 0.67 RYR2 (0.48) MAPK1
SCHEMBL13945551 0.64 DRD2 (0.59)
SCHEMBL379244 0.64 MAPK1 (0.66) CREBBPAHRMAPK1HPGDBAZ2B
SCHEMBL19657579 0.64 MAPK1 (0.54) GPR142CREBBPAHRMAPK1HPGD

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-2017205536-A2 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2017-11-30 WO disclosed