SCHEMBL23864264

SCHEMBL23864264

C=Cc1ccc(CNC(=C)c2ccccc2C(=C)O)c(C(=C)N)c1

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.32
MCL1 Q07820 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
SCHEMBL23864347 0.72 ALDH1A1 (0.37)
SCHEMBL23864392 0.71 HTT (0.30)
SCHEMBL23864573 0.66
SCHEMBL23864239 0.62
SCHEMBL23864267 0.62 TAS1R3 (0.41)
SCHEMBL23864375 0.61 HDAC2 (0.37)
SCHEMBL21969580 0.59 ALDH1A1 (0.47)
SCHEMBL20724985 0.57 ALDH1A1 (0.43) PARP1
SCHEMBL12018275 0.57 ALDH1A1 (0.42) PARP1
SCHEMBL12525977 0.57 NSD2 (0.54)

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-2968330-B1 COMPOUNDS AND METHODS FOR INDUCING CHONDROGENESIS SCRIPPS RESEARCH INST (US) 2021-09-29 EP disclosed