SCHEMBL31348985

SCHEMBL31348985

N#Cc1ccc(C(=O)N(O)c2cccc(C(=O)Nc3c(I)cc(C(F)(C(F)(F)F)C(F)(F)F)cc3C(F)(F)F)c2F)cc1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 2/20 0.41
TRPM8 Q7Z2W7 1/20 0.33
VNN1 O95497 1/20 0.33
TRPA1 O75762 1/20 0.33
SMO Q99835 1/20 0.33
NR1H4 Q96RI1 1/20 0.33
TRPV1 Q8NER1 1/20 0.33
ABCC9 O60706 1/20 0.32
ABCC8 Q09428 1/20 0.32
KCNJ11 Q14654 1/20 0.32
KCNJ8 Q15842 1/20 0.32
TMPRSS4 Q9NRS4 1/20 0.32
HSD11B1 P28845 1/20 0.32
LRRK2 Q5S007 1/20 0.31
PTGES O14684 1/20 0.31
MLYCD O95822 2/20 0.31
KAT6A Q92794 1/20 0.30

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
SCHEMBL1766651 0.91 RXFP1 (0.40) RXFP1TRPM8VNN1TRPA1SMO
SCHEMBL31348935 0.91 CA12 (0.33) RXFP1KCNJ11LRRK2PTGES
SCHEMBL31348958 0.90 RXFP1 (0.39) RXFP1TRPM8VNN1TRPA1SMO
SCHEMBL31348955 0.89 RXFP1 (0.38) RXFP1NR1H4TRPV1ABCC9ABCC8
SCHEMBL24914654 0.88 RXFP1 (0.38) RXFP1TRPM8VNN1TRPA1NR1H4
SCHEMBL1766918 0.87 RXFP1 (0.39) RXFP1TRPM8VNN1TRPA1SMO
SCHEMBL24914954 0.87 RXFP1 (0.37) RXFP1TRPM8VNN1TRPA1ABCC9
SCHEMBL21701238 0.86 RXFP1 (0.37) RXFP1VNN1SMOHSD11B1MLYCD
SCHEMBL1766763 0.85 RXFP1 (0.52) RXFP1TRPM8NR1H4TRPV1ABCC9
SCHEMBL31348968 0.85 KDM4E (0.35) RXFP1TRPV1TMPRSS4PTGES

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-119059936-A Meta-aminobenzoic acid bisamide compound 湖南化工研究院有限公司 2024-12-03 CN disclosed