SCHEMBL23864302

SCHEMBL23864302

C=Cc1ccccc1C(=C)NCc1ccc(C(=C)C)cc1CC

nearest known ligand 0.31

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
BCHE P06276 3/20 0.31
AVPR2 P30518 1/20 0.30
LMNA P02545 1/20 0.30
MAPK1 P28482 1/20 0.30
NLRP1 Q9C000 1/20 0.30
HDAC8 Q9BY41 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
SCHEMBL23864599 0.92 HTT (0.36) BCHELMNA
SCHEMBL23864239 0.88
SCHEMBL23864210 0.87 HPGD (0.35) AVPR2LMNA
SCHEMBL23864539 0.86 HPGD (0.33) BCHEAVPR2LMNAMAPK1NLRP1
SCHEMBL23864447 0.82 AKR1C3 (0.36) LMNA
SCHEMBL23864573 0.81
SCHEMBL23864738 0.81 HPGD (0.34) LMNA
SCHEMBL23864267 0.74 TAS1R3 (0.41) LMNA
SCHEMBL23864683 0.73 NR1H4 (0.35) MAPK1
SCHEMBL11511287 0.73 HSD17B1 (0.33)

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