SCHEMBL23864263

SCHEMBL23864263

C=Cc1ccc(CNC(=C)c2cccc(F)c2C(=C)C)cc1

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.35
▸ ALDH1A1 P00352 4/20 0.33
▸ KDM4E B2RXH2 2/20 0.33
▸ ALDH2 P05091 1/20 0.33
▸ ALOX12 P18054 1/20 0.33
▸ HPGD P15428 1/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ HDAC3 O15379 1/20 0.31
▸ HDAC8 Q9BY41 1/20 0.31
▸ HDAC6 Q9UBN7 1/20 0.31
▸ PLK1 P53350 1/20 0.31
▸ ERAP1 Q9NZ08 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
SCHEMBL23864370 0.90 LMNA (0.35) LMNAALDH1A1KDM4EALDH2ALOX12
SCHEMBL23864246 0.85 TXNRD1 (0.36) LMNAALDH1A1ALDH2HPGDKMT2A
SCHEMBL23864637 0.79 TXNRD1 (0.37) LMNAALDH1A1ALDH2HPGDKMT2A
SCHEMBL23864361 0.76 PLA2G1B (0.36) LMNAALDH1A1KDM4EHPGDKMT2A
SCHEMBL23864334 0.73 HPGD (0.43) LMNAALDH1A1KDM4EHPGDKMT2A
SCHEMBL23864366 0.71 MAPT (0.37) ALDH1A1HPGDKMT2ACYP1A2CYP2C19
SCHEMBL23864723 0.71 MAPT (0.37) LMNAALDH1A1HPGDKMT2ACYP1A2
SCHEMBL23864221 0.70 TXNRD1 (0.38) ALDH1A1ALDH2KMT2AHDAC6
SCHEMBL4607284 0.67 KMT2A (0.58) ALDH1A1KDM4EKMT2AHDAC3HDAC8
SCHEMBL23810069 0.66 ALDH1A1 (0.44) LMNAALDH1A1ALOX12HPGDKMT2A

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
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