SCHEMBL4819481

SCHEMBL4819481

Cc1cc2c(Nc3cc(-c4ccc(-c5ccccc5C(F)(F)F)cc4)ncn3)cccc2n(C)c1=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 3/20 0.43
CYP1A2 P05177 9/20 0.43
CYP3A4 P08684 6/20 0.43
CYP2C19 P33261 7/20 0.39
CYP2D6 P10635 5/20 0.39
ALDH1A1 P00352 3/20 0.39
ALOX15 P16050 2/20 0.39
TSHR P16473 7/20 0.38
KDM4E B2RXH2 1/20 0.38
HSD17B10 Q99714 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
HIF1A Q16665 3/20 0.38
USP2 O75604 3/20 0.38
MAPK1 P28482 3/20 0.38
CYP2C9 P11712 1/20 0.38
LMNA P02545 1/20 0.38
TP53 P04637 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
ABL1 P00519 2/20 0.37

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
SCHEMBL4720717 0.88 TRPV1 (0.56) TRPV1ABL1BCR
SCHEMBL4819485 0.88 TRPV1 (0.47) TRPV1CYP1A2CYP3A4CYP2C19CYP2D6
SCHEMBL4819487 0.87 TRPV1 (0.55) TRPV1ABL1BCRBACE1
SCHEMBL4715985 0.75 MAPK10 (0.44) TRPV1ABL1
SCHEMBL4716112 0.70 MAPK10 (0.39) TRPV1CYP1A2ALDH1A1KDM4EHSD17B10
SCHEMBL4718655 0.69 TRPV1 (0.59) TRPV1ABL1BCR
SCHEMBL1013451 0.68 TRPV1 (0.60) TRPV1CYP1A2CYP3A4CYP2C19CYP2D6
SCHEMBL1013757 0.66 TRPV1 (0.78) TRPV1ABL1BCR
SCHEMBL13868149 0.66 TRPV1 (0.55) TRPV1ABL1BCR
SCHEMBL4717536 0.64 TRPV1 (0.61) TRPV1ABL1BCR

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
US-7442701-B2 Amino-heterocycles as VR-1 antagonists for treating pain MERCK SHARP & DOHME LTD. (GB) 2008-10-28 US disclosed
US-20060040947-A1 Amino-heterocycles as vr-1 antagonists for treating pain MERCK SHARP & DOHME LTD. (GB) 2006-02-23 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060040947-A1 Amino-heterocycles as vr-1 antagonists for treating pain OPRL1, CNR1, GPR6 TRPV1 40/4885CYP1A2 1198/4885CYP3A4 977/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.