SCHEMBL20124440

SCHEMBL20124440

Cc1ccc(C)c2c1C=CNC2

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.32
HTR2C P28335 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
SCHEMBL1826218 0.65 CYP1A2 (0.32)
SCHEMBL16247853 0.64
SCHEMBL19142438 0.64
Lithium SCHEMBL29650829 0.64 CYP1A2 (0.31)
SCHEMBL22228283 0.64 CYP1A2 (0.31)
SCHEMBL13569488 0.62 ADORA3 (0.32)
SCHEMBL14481407 0.58 CYP1A2 (0.38) PARP1HTR2C
SCHEMBL2673180 0.57
SCHEMBL30666768 0.56
SCHEMBL5029748 0.56 DRD4 (0.42) HTR2C

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
EP-3082173-B1 ORGANIC LIGHT EMITTING DISPLAY DEVICE LG DISPLAY CO LTD (KR) 2018-05-09 EP disclosed