SCHEMBL9484248

SCHEMBL9484248

C=CCCCCCCCCCc1ccccc1C=C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
USP2 O75604 1/20 0.46
HPGD P15428 1/20 0.46
TLR8 Q9NR97 1/20 0.40
HDAC1 Q13547 2/20 0.39
HDAC4 P56524 1/20 0.38
EP300 Q09472 1/20 0.38
KAT2B Q92831 1/20 0.38
KAT5 Q92993 1/20 0.38
KAT8 Q9H7Z6 1/20 0.38
LMNA P02545 2/20 0.35
THRA P10827 1/20 0.35
THRB P10828 1/20 0.35
TSHR P16473 1/20 0.34
LIPG Q9Y5X9 1/20 0.33
BID P55957 2/20 0.31
BCL2L1 Q07817 2/20 0.31
MCL1 Q07820 2/20 0.31
BAK1 Q16611 2/20 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
SCHEMBL656699 0.92 TLR8 (0.45) ALDH1A1TDP1USP2HPGDTLR8
SCHEMBL6278185 0.90 ALDH1A1 (0.43) ALDH1A1TDP1USP2HPGDEP300
SCHEMBL6285088 0.90 ALDH1A1 (0.43) ALDH1A1TDP1USP2HPGDEP300
SCHEMBL6278393 0.90 ALDH1A1 (0.43) ALDH1A1TDP1USP2HPGDEP300
SCHEMBL6280633 0.90 ALDH1A1 (0.43) ALDH1A1TDP1USP2HPGDEP300
SCHEMBL6278186 0.90 ALDH1A1 (0.43) ALDH1A1TDP1USP2HPGDEP300
SCHEMBL6281460 0.90 ALDH1A1 (0.43) ALDH1A1TDP1USP2HPGDEP300
SCHEMBL31054112 0.88 ALDH1A1 (0.44) ALDH1A1TDP1TLR8EP300KAT2B
SCHEMBL6284419 0.88 ALDH1A1 (0.44) ALDH1A1TDP1TLR8EP300KAT2B
SCHEMBL29180939 0.86 THRB (0.36) ALDH1A1TDP1USP2HPGDEP300

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-0532577-A1 FUNCTIONALIZED TRIFLUOROVINYL ETHERS AND POLYMERS THEREFROM. DU PONT (US) 1993-03-24 EP disclosed