SCHEMBL23864447

SCHEMBL23864447

C=Cc1ccccc1C(=C)NCc1ccc(C(C)=O)cc1C(=C)C

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 5/20 0.36
AKR1C2 P52895 5/20 0.36
AKR1B10 O60218 1/20 0.34
AKR1B1 P15121 1/20 0.34
AKR1C4 P17516 1/20 0.34
AKR1C1 Q04828 1/20 0.34
HTT P42858 2/20 0.33
KMT2A Q03164 4/20 0.33
MEN1 O00255 3/20 0.33
CDK2 P24941 1/20 0.33
HPGD P15428 3/20 0.33
ALDH1A1 P00352 2/20 0.33
MAPT P10636 2/20 0.33
LMNA P02545 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
CREBBP Q92793 1/20 0.31
NQO2 P16083 1/20 0.31
PKM P14618 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
SCHEMBL23864239 0.92
SCHEMBL23864573 0.89
SCHEMBL23864599 0.88 HTT (0.36) AKR1C3AKR1C2AKR1B10AKR1B1AKR1C4
SCHEMBL23864302 0.82 BCHE (0.31) LMNA
SCHEMBL23864210 0.81 HPGD (0.35) HTTKMT2AHPGDALDH1A1MAPT
SCHEMBL23864738 0.78 HPGD (0.34) HTTKMT2AMEN1HPGDALDH1A1
SCHEMBL23864683 0.75 NR1H4 (0.35) HTTKMT2AMEN1HPGDALDH1A1
SCHEMBL23864208 0.74 HPGD (0.32) KMT2AMEN1HPGDALDH1A1LMNA
SCHEMBL23864267 0.74 TAS1R3 (0.41) HTTKMT2AMEN1HPGDALDH1A1
SCHEMBL23864539 0.70 HPGD (0.33) HTTHPGDALDH1A1MAPTLMNA

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