SCHEMBL17766740

SCHEMBL17766740

O=C(O)c1sc(C2CCN(C(=O)Nc3ccc(C(F)(F)F)cc3)CC2)nc1-c1ccc(F)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 6/20 0.48
▸ KMT2A Q03164 4/20 0.48
▸ MAPT P10636 4/20 0.48
▸ LMNA P02545 3/20 0.48
▸ SMN1; SMN2 Q16637 3/20 0.48
▸ MEN1 O00255 2/20 0.48
▸ HTT P42858 2/20 0.48
▸ RECQL P46063 1/20 0.48
▸ NPSR1 Q6W5P4 2/20 0.46
▸ TSHR P16473 1/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ EPHX2 P34913 1/20 0.45
▸ KCNH2 Q12809 1/20 0.45
▸ CACNA1C Q13936 1/20 0.45
▸ PRKAB2 O43741 1/20 0.44
▸ PRKAG1 P54619 1/20 0.44
▸ PRKAA2 P54646 1/20 0.44
▸ PRKAA1 Q13131 1/20 0.44
▸ PRKAG3 Q9UGI9 1/20 0.44
▸ PRKAG2 Q9UGJ0 1/20 0.44

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
SCHEMBL17766714 0.93 TRPV1 (0.55) TRPV1KMT2AMAPTLMNASMN1; SMN2
SCHEMBL17766774 0.90 HPGDS (0.51) TRPV1KMT2AMAPTLMNASMN1; SMN2
SCHEMBL17766728 0.89 BTK (0.52) TRPV1KMT2AMAPTLMNASMN1; SMN2
SCHEMBL17766703 0.88 TRPV1 (0.54) TRPV1KMT2AMAPTLMNASMN1; SMN2
SCHEMBL19362084 0.87 DHODH (0.51) TRPV1KMT2AMAPTLMNASMN1; SMN2
SCHEMBL17766716 0.86 TRPV1 (0.48) TRPV1KMT2AMAPTLMNASMN1; SMN2
SCHEMBL17766781 0.86 TRPV1 (0.52) TRPV1KMT2AMAPTLMNASMN1; SMN2
SCHEMBL17766772 0.85 TRPV1 (0.51) TRPV1KMT2AMAPTLMNASMN1; SMN2
SCHEMBL17766752 0.85 TRPV1 (0.53) TRPV1KMT2AMAPTLMNASMN1; SMN2
SCHEMBL17766730 0.85 TRPV1 (0.56) TRPV1KMT2AMAPTLMNASMN1; SMN2

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-9771357-B2 ALXR agonist compound ONO PHARMACEUTICAL CO., LTD. (JP) 2017-09-26 — — US disclosed
US-20160145249-A1 ALXR AGONIST COMPOUND ONO PHARMACEUTICAL CO., LTD. (JP) 2016-05-26 — — 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-20160145249-A1 ALXR AGONIST COMPOUND MRGPRX2, MRGPRX1, MRGPRX4 TRPV1 319/4885KMT2A 2119/4885MAPT 1943/4885

“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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