SCHEMBL20436799

SCHEMBL20436799

Cc1c(Cl)cccc1NC(=O)Nc1cccc(O)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 4/20 1.00
▸ LMNA P02545 3/20 0.75
▸ POLB P06746 2/20 0.75
▸ SMN1; SMN2 Q16637 4/20 0.61
▸ KDM4E B2RXH2 1/20 0.60
▸ MAPT P10636 5/20 0.58
▸ ALDH1A1 P00352 3/20 0.58
▸ TP53 P04637 1/20 0.58
▸ GRIK1 P39086 1/20 0.56
▸ HPGD P15428 1/20 0.55
▸ DDX3X O00571 1/20 0.54
▸ NPC1 O15118 1/20 0.53
▸ RAB9A P51151 1/20 0.53
▸ MEN1 O00255 1/20 0.52
▸ KMT2A Q03164 1/20 0.52

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
SCHEMBL22125270 0.80 POLB (0.66) TRPV1LMNAPOLBSMN1; SMN2KDM4E
SCHEMBL9400341 0.79 ALDH1A1 (0.70) TRPV1LMNASMN1; SMN2MAPTALDH1A1
SCHEMBL1877761 0.77 EPHX1 (0.73) TRPV1LMNAPOLBSMN1; SMN2KDM4E
SCHEMBL30589624 0.77 MEN1 (0.82) TRPV1LMNASMN1; SMN2KDM4EMAPT
SCHEMBL28914350 0.77 MEN1 (0.82) TRPV1LMNASMN1; SMN2KDM4EMAPT
SCHEMBL22425034 0.77 MAPT (0.77) TRPV1LMNAPOLBSMN1; SMN2KDM4E
SCHEMBL1463506 0.75 GRIK1 (0.73) TRPV1LMNAKDM4EMAPTALDH1A1
SCHEMBL20442328 0.75 TRPV1 (1.00) TRPV1LMNAPOLBSMN1; SMN2KDM4E
SCHEMBL22588913 0.75 NPC1 (0.69) TRPV1LMNAPOLBSMN1; SMN2MAPT
SCHEMBL8421306 0.75 SMN1; SMN2 (0.63) TRPV1LMNAPOLBSMN1; SMN2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11339122-B2 hTRPV1 chemical agents University of Pittsburgh—of the Commonwealth System of Higher Education (US) 2022-05-24 — — US disclosed
US-20210171454-A1 hTRPV1 CHEMICAL AGENTS UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2021-06-10 — — US disclosed
US-20180215705-A1 hTRPV1 CHEMICAL AGENTS UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2018-08-02 — — US disclosed
US-20180215705-A1 hTRPV1 CHEMICAL AGENTS UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2018-08-02 — — 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 (3 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-20180215705-A1 hTRPV1 CHEMICAL AGENTS TRPV1, TRPA1, TRPV4 TRPV1 1/4885LMNA 4320/4885POLB 4677/4885
US-20210171454-A1 hTRPV1 CHEMICAL AGENTS TRPV1, TRPA1, TRPV4 TRPV1 1/4885LMNA 3964/4885POLB 4664/4885
US-11339122-B2 hTRPV1 chemical agents TRPV1, TRPA1, TRPV4 TRPV1 1/4885LMNA 4320/4885POLB 4677/4885

“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.

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