SCHEMBL31339954

SCHEMBL31339954

Cc1cnc(NC(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)nc1-c1ccc(C#N)cc1

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ VNN1 O95497 3/20 0.45
▸ TRPV1 Q8NER1 4/20 0.45
▸ PIK3CA P42336 1/20 0.44
▸ SORT1 Q99523 1/20 0.44
▸ LRRK2 Q5S007 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ SAE1 Q9UBE0 1/20 0.43
▸ UBA2 Q9UBT2 1/20 0.43
▸ MCHR1 Q99705 1/20 0.42
▸ KCNH2 Q12809 1/20 0.41
▸ SCN10A Q9Y5Y9 1/20 0.41
▸ TMPRSS4 Q9NRS4 1/20 0.40

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
SCHEMBL31339978 0.87 BTK (0.48) TRPV1SORT1MCHR1
SCHEMBL31339990 0.86 SORT1 (0.50) TRPV1SORT1MCHR1
SCHEMBL31339994 0.85 TRPV1 (0.46) TRPV1SORT1MCHR1
SCHEMBL31340012 0.84 KDM4E (0.46) TRPV1SORT1KDM4EMAPT
SCHEMBL31339981 0.83 ALDH1A1 (0.43) TRPV1SORT1MAPTMCHR1TMPRSS4
SCHEMBL31340005 0.81 TRPV1 (0.46) TRPV1
SCHEMBL31339987 0.80 TRPV1 (0.57) TRPV1KDM4EMAPT
SCHEMBL31340007 0.78 PTGS1 (0.54) TRPV1SORT1
SCHEMBL31339962 0.78 LCK (0.59) TRPV1
SCHEMBL31339943 0.74 TRPV1 (0.48) TRPV1SORT1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260124202-A1 CD97 AND GSDME INTERACTION INHIBITOR HAVING ANTI-TUMOR ACTIVITY AND APPLICATION THEREOF JILIN UNIVERSITY (CN) 2026-05-07 — — US disclosed
EP-4725485-A1 CD97 AND GSDME INTERACTION INHIBITOR HAVING ANTI-TUMOR ACTIVITY AND APPLICATION THEREOF Jilin University (CN) 2026-04-15 — — EP disclosed
CN-119285557-A CD97 and GSDME interaction inhibitor with anti-tumor activity and application thereof 吉林大学 2025-01-10 — — CN 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-20260124202-A1 CD97 AND GSDME INTERACTION INHIBITOR HAVING ANTI-TUMOR ACTIVITY AND APPLICATION THEREOF GZMB, CD74, GSDMD VNN1 4421/4885TRPV1 1150/4885PIK3CA 2743/4885

“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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