SCHEMBL4134472

SCHEMBL4134472

CCCCCCCCC(=O)NCc1ccc(OCO)cc1

nearest known ligand 0.75

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
STS P08842 1/20 0.67
CNR1 P21554 2/20 0.65
EPHX2 P34913 5/20 0.65
TRPV1 Q8NER1 1/20 0.59
LMNA P02545 1/20 0.59
HPGD P15428 2/20 0.57
ALDH1A1 P00352 1/20 0.57
CNR2 P34972 1/20 0.57
FAAH O00519 1/20 0.56

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
SCHEMBL3809498 0.87 EPHX2 (0.84) STSCNR1EPHX2TRPV1HPGD
SCHEMBL12215285 0.86 CNR1 (0.85) STSCNR1EPHX2HPGDALDH1A1
SCHEMBL9320928 0.85 STS (0.66) STSCNR1EPHX2TRPV1LMNA
SCHEMBL16762031 0.84 CNR1 (0.82) STSCNR1EPHX2ALDH1A1CNR2
SCHEMBL8594556 0.82 EPHX2 (0.60) STSCNR1EPHX2TRPV1LMNA
SCHEMBL7271203 0.81 EPHX2 (0.74) STSCNR1EPHX2TRPV1HPGD
SCHEMBL7199890 0.81 EPHX2 (0.74) STSCNR1EPHX2TRPV1HPGD
SCHEMBL7200728 0.81 EPHX2 (0.74) STSCNR1EPHX2TRPV1HPGD
SCHEMBL7264157 0.81 EPHX2 (0.74) STSCNR1EPHX2TRPV1HPGD
SCHEMBL7271387 0.81 EPHX2 (0.74) STSCNR1EPHX2TRPV1HPGD

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-20090131532-A1 Method of preemptive treatment of inflammation, algesia and poor healing using topical capsaicin MFM MEDICAL ENTERPRISES 2009-05-21 US disclosed