SCHEMBL7737889

SCHEMBL7737889

CCCCCCCCc1cc(C2CCCCC2)ccc1O

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ACMSD Q8TDX5 2/20 0.46
TYR P14679 2/20 0.45
MEN1 O00255 1/20 0.45
TP53 P04637 1/20 0.45
CYP3A4 P08684 1/20 0.45
ALOX5 P09917 1/20 0.45
MAPT P10636 1/20 0.45
ALOX15 P16050 1/20 0.45
TSHR P16473 1/20 0.45
HTT P42858 1/20 0.45
KMT2A Q03164 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
CNR1 P21554 4/20 0.45
CNR2 P34972 3/20 0.45
SPHK1 Q9NYA1 3/20 0.43
RBP1 P09455 1/20 0.42
EPHX2 P34913 1/20 0.42

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
SCHEMBL27809930 0.94 ACMSD (0.48) ACMSDTYRCNR1CNR2EPHX2
SCHEMBL10866678 0.91 SPHK1 (0.48) TYRMEN1TP53CYP3A4ALOX5
SCHEMBL5208280 0.88 EPHX2 (0.52) ACMSDALOX5CNR1CNR2EPHX2
SCHEMBL2721546 0.87 TP53 (0.51) TYRMEN1TP53CYP3A4ALOX5
SCHEMBL2718706 0.87 TP53 (0.51) TYRMEN1TP53CYP3A4ALOX5
SCHEMBL2718788 0.87 TP53 (0.51) TYRMEN1TP53CYP3A4ALOX5
SCHEMBL2720022 0.86 CYP3A4 (0.49) TYRMEN1TP53CYP3A4ALOX5
SCHEMBL18457309 0.83 SPHK1 (0.43) SPHK1EPHX2
SCHEMBL11161163 0.82 ACMSD (0.57) ACMSDEPHX2
SCHEMBL6940429 0.81 TYR (0.51) TYRMEN1TP53CYP3A4ALOX5

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
US-6403652-B1 A METHOD FOR INHIBITING METHICILLIN DRUG RESISTANT BACTERIA USING A PHENOLIC COMPOUND. COLGATE-PALMOLIVE COMPANY 2002-06-11 US disclosed