SCHEMBL14887348

SCHEMBL14887348

Cc1cc2c(cc1-c1ccc(NC(=O)c3csnc3C)cc1)OC(F)(F)O2

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ SCN9A Q15858 1/20 0.43
▸ STIM1 Q13586 2/20 0.41
▸ ORAI1 Q96D31 2/20 0.41
▸ POLQ O75417 1/20 0.40
▸ IL2 P60568 2/20 0.38
▸ KIT P10721 9/20 0.37
▸ BRAF P15056 9/20 0.37
▸ KDM4E B2RXH2 1/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ STAT1 P42224 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ LCK P06239 1/20 0.35
▸ KDR P35968 1/20 0.35
▸ MAPK14 Q16539 1/20 0.35
▸ ADORA3 P0DMS8 1/20 0.35
▸ ADORA2A P29274 1/20 0.35
▸ ADORA2B P29275 1/20 0.35
▸ ADORA1 P30542 1/20 0.35
▸ ORAI2 Q96SN7 1/20 0.35

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
SCHEMBL14887584 0.90 STIM1 (0.42) SCN9ASTIM1ORAI1POLQIL2
SCHEMBL14885660 0.88 STIM1 (0.51) SCN9ASTIM1ORAI1POLQIL2
SCHEMBL16017226 0.84 SCN9A (0.45) SCN9ASTIM1ORAI1POLQIL2
SCHEMBL14887583 0.83 SCN9A (0.43) SCN9ASTIM1ORAI1POLQIL2
SCHEMBL17805358 0.82 SMN1; SMN2 (0.51) SCN9AKDM4ENPC1STAT1RAB9A
SCHEMBL16017232 0.81 SCN9A (0.45) SCN9ASTIM1ORAI1POLQIL2
SCHEMBL16019777 0.81 ALDH1A1 (0.53) SCN9ASTIM1ORAI1NPC1RAB9A
SCHEMBL14881301 0.81 MEN1 (0.53) SCN9ASTIM1ORAI1IL2KDM4E
SCHEMBL14887577 0.80 HSD17B10 (0.55) SCN9ASTIM1ORAI1IL2NPC1
SCHEMBL14885664 0.79 STIM1 (0.52) SCN9ASTIM1ORAI1POLQIL2

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-20140256771-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM CALCIMEDICA, INC. 2014-09-11 — — US disclosed
WO-2013059666-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM CALCIMEDICA, INC. (US) 2013-04-25 — — WO 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 SCN9A 235/4885STIM1 17/4885ORAI1 1/4885

“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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