SCHEMBL28814682

SCHEMBL28814682

NCC(O)CCCCCCCCCCCCCCCCCCCCC(O)CN

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GABRR1 P24046 3/20 0.39
TRPV1 Q8NER1 1/20 0.39
TRPA1 O75762 1/20 0.39
LMNA P02545 1/20 0.39
HTT P42858 1/20 0.38
CYP1A2 P05177 1/20 0.36
CYP2C9 P11712 1/20 0.36
TSHR P16473 1/20 0.36
HIF1A Q16665 1/20 0.36
GPR84 Q9NQS5 4/20 0.36
GABBR2 O75899 1/20 0.35
GABBR1 Q9UBS5 1/20 0.35
FFAR4 Q5NUL3 1/20 0.34

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
SCHEMBL27987510 1.00 GABRR1 (0.39) GABRR1TRPV1TRPA1LMNAHTT
SCHEMBL27987515 1.00 GABRR1 (0.39) GABRR1TRPV1TRPA1LMNAHTT
SCHEMBL28204122 1.00 GABRR1 (0.39) GABRR1TRPV1TRPA1LMNAHTT
SCHEMBL7105689 1.00 GABRR1 (0.39) GABRR1TRPV1TRPA1LMNAHTT
SCHEMBL15871152 1.00 GABRR1 (0.39) GABRR1TRPV1TRPA1LMNAHTT
SCHEMBL20484614 0.97 GABRR1 (0.41) GABRR1TRPV1TRPA1LMNAHTT
SCHEMBL1039819 0.91 DNM1 (0.44) TRPV1TRPA1LMNATSHR
SCHEMBL31708187 0.91 DNM1 (0.44) TRPV1TRPA1LMNATSHR
SCHEMBL27796865 0.89 PTPN1 (0.36) GABRR1TRPV1LMNAHTTTSHR
SCHEMBL6537033 0.89 PTPN1 (0.36) GABRR1TRPV1LMNAHTTTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104169402-A Lubricating oil composition and sliding mechanism using same IDEMITSU KOSAN CO 2014-11-26 CN disclosed
CN-104169403-A Lubricating oil composition and sliding mechanism using same IDEMITSU KOSAN CO 2014-11-26 CN disclosed