SCHEMBL24914860

SCHEMBL24914860

Bc1c(C(=O)Nc2c(I)cc(C(F)(C(F)(F)F)C(F)(F)F)cc2C(F)(F)F)cccc1N(CC=C)C(=O)c1ccc(C#N)cc1

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 2/20 0.39
MLYCD O95822 1/20 0.33
TRPM8 Q7Z2W7 1/20 0.32
NR1H4 Q96RI1 1/20 0.31
TRPV1 Q8NER1 1/20 0.31
ABCC9 O60706 1/20 0.31
ABCC8 Q09428 1/20 0.31
KCNJ11 Q14654 1/20 0.31
KCNJ8 Q15842 1/20 0.31
TMPRSS4 Q9NRS4 1/20 0.30
VNN1 O95497 1/20 0.30
TRPA1 O75762 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
SCHEMBL24914954 0.92 RXFP1 (0.37) RXFP1MLYCDTRPM8ABCC9ABCC8
SCHEMBL24914763 0.83 KCNK3 (0.35) RXFP1NR1H4KCNJ11
SCHEMBL24914948 0.82 KCNK3 (0.34) RXFP1KCNJ11
SCHEMBL24914857 0.82 BRAF (0.33)
SCHEMBL24914654 0.81 RXFP1 (0.38) RXFP1MLYCDTRPM8NR1H4TRPV1
SCHEMBL31348985 0.80 RXFP1 (0.41) RXFP1MLYCDTRPM8NR1H4TRPV1
SCHEMBL21701238 0.80 RXFP1 (0.37) RXFP1MLYCDVNN1
SCHEMBL1766651 0.80 RXFP1 (0.40) RXFP1MLYCDTRPM8NR1H4TRPV1
SCHEMBL24915210 0.79 BRAF (0.33) RXFP1
SCHEMBL24914495 0.79 PTGES (0.31)

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
WO-2023284645-A1 AMIDE COMPOUND AND USE THEREOF 沈阳化工大学 2023-01-19 WO disclosed