SCHEMBL11094348

SCHEMBL11094348

CCCCCCCCCc1cccc(O)c1CCO

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BID P55957 6/20 0.56
MCL1 Q07820 6/20 0.56
BCL2L1 Q07817 5/20 0.56
BAK1 Q16611 5/20 0.56
KAT8 Q9H7Z6 3/20 0.56
SAE1 Q9UBE0 2/20 0.56
EP300 Q09472 2/20 0.56
KAT5 Q92993 2/20 0.56
PPARG P37231 1/20 0.56
PPARA Q07869 1/20 0.56
KAT2A Q92830 1/20 0.56
KAT2B Q92831 1/20 0.56
F7 P08709 3/20 0.49
F3 P13726 3/20 0.49
MMP2 P08253 2/20 0.49
MAPT P10636 2/20 0.49
ALOX15 P16050 2/20 0.49
KDM4E B2RXH2 1/20 0.49
ECE1 P42892 1/20 0.49
SGMS1 Q86VZ5 1/20 0.49

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
SCHEMBL27283417 0.93 BID (0.53) BIDMCL1BCL2L1BAK1KAT8
Cetostearyl Alcohol SCHEMBL10489634 0.92 BID (0.55) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL982794 0.91 BID (0.61) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL984168 0.91 BID (0.61) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL982243 0.91 BID (0.61) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL982154 0.91 BID (0.61) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL632247 0.91 BID (0.61) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL980283 0.91 BID (0.61) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL984157 0.91 BID (0.61) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL1003820 0.91 BID (0.61) BIDMCL1BCL2L1BAK1KAT8

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112872002-A Application of selenium combined pseudomonas aeruginosa in strengthening phytoremediation of cadmium-nonylphenol composite contaminated soil 华中农业大学 2021-06-01 CN disclosed
US-4473374-A Nitrated coupler compounds useful in direct dyeing and simultaneous oxidation and direct dyeing of keratinic fibers SOCIETE ANONYME DITE: L'OREAL (FR) 1984-09-25 US disclosed
US-4330291-A Nitrated coupler compounds useful in direct dyeing and simultaneous oxidation and direct dyeing of keratinic fibers SOCIETE ANONYME DITE: L'OREAL (FR) 1982-05-18 US disclosed