SCHEMBL16017348

SCHEMBL16017348

Cc1cc(F)c(C(=O)Nc2ccc(Oc3ncccc3C(F)(F)F)cc2)c(F)c1

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 3/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ P2RY1 P47900 1/20 0.47
▸ S1PR3 Q99500 1/20 0.46
▸ KCNH2 Q12809 1/20 0.46
▸ NPC1 O15118 1/20 0.45
▸ RAB9A P51151 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45

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
SCHEMBL16017358 0.95 LMNA (0.47) TRPV1KMT2AP2RY1S1PR3KCNH2
SCHEMBL14887509 0.92 S1PR3 (0.52) TRPV1KMT2AP2RY1S1PR3
SCHEMBL14887492 0.89 JAK2 (0.53) KMT2A
SCHEMBL16019814 0.89 S1PR3 (0.48) TRPV1KMT2AP2RY1S1PR3
SCHEMBL14887497 0.87 KMT2A (0.49) TRPV1KMT2AS1PR3NPC1RAB9A
SCHEMBL14887510 0.87 TLR8 (0.48) TRPV1KMT2A
SCHEMBL16017371 0.86 CDK8 (0.44) KMT2AS1PR3NPC1SMN1; SMN2
SCHEMBL16017370 0.86 KMT2A (0.46) TRPV1KMT2AS1PR3
SCHEMBL16019807 0.86 KMT2A (0.46) TRPV1KMT2AP2RY1S1PR3
SCHEMBL16017353 0.85 S1PR3 (0.44) KMT2AS1PR3NPC1SMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140256771-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM CALCIMEDICA, INC. 2014-09-11 — — 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-20140256771-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM ORAI1, SARAF, RYR2 TRPV1 50/4885KMT2A 4706/4885P2RY1 207/4885

“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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