SCHEMBL28243243

SCHEMBL28243243

CCCCCCCCCCCCCCCCCC.CCCCCCCCCCCCCCCCCCc1ccc[nH]c1=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 2/20 0.49
LIPG Q9Y5X9 1/20 0.47
NR1H2 P55055 1/20 0.46
NR1H3 Q13133 1/20 0.46
BID P55957 3/20 0.44
MCL1 Q07820 3/20 0.44
PPARA Q07869 3/20 0.44
BCL2L1 Q07817 2/20 0.44
BAK1 Q16611 2/20 0.44
KAT8 Q9H7Z6 2/20 0.44
PPARG P37231 2/20 0.44
EP300 Q09472 1/20 0.44
KAT2A Q92830 1/20 0.44
KAT2B Q92831 1/20 0.44
KAT5 Q92993 1/20 0.44
SAE1 Q9UBE0 1/20 0.44
THRA P10827 1/20 0.40
THRB P10828 1/20 0.40
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40

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
SCHEMBL5166986 1.00 GPR84 (0.49) GPR84LIPGNR1H2NR1H3BID
SCHEMBL10767574 1.00 GPR84 (0.49) GPR84LIPGNR1H2NR1H3BID
SCHEMBL27397512 1.00 GPR84 (0.49) GPR84LIPGNR1H2NR1H3BID
SCHEMBL10764266 1.00 GPR84 (0.49) GPR84LIPGNR1H2NR1H3BID
SCHEMBL14974903 1.00 GPR84 (0.49) GPR84LIPGNR1H2NR1H3BID
SCHEMBL2495417 0.98 GPR84 (0.46) GPR84LIPGNR1H2NR1H3BID
SCHEMBL10692239 0.93 DAO (0.41) GPR84LIPGNR1H2NR1H3BID
SCHEMBL9234355 0.91 DAO (0.45) GPR84LIPGNR1H2NR1H3BID
SCHEMBL174911 0.85 KDM4E (0.44) GPR84MCL1THRBKDM4EALDH1A1
SCHEMBL28003330 0.83 BID (0.44) GPR84BIDMCL1PPARABCL2L1

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
CN-105694587-B Phase change ink for ophthalmic lens label 施乐公司 2018-09-11 CN disclosed