SCHEMBL14887769

SCHEMBL14887769

Cc1noc(C(F)(F)F)c1C(=O)Nc1ccc(-c2cc3c(cc2Cl)OC(F)(F)O3)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ STIM1 Q13586 1/20 0.43
▸ ORAI1 Q96D31 1/20 0.43
▸ ORAI2 Q96SN7 1/20 0.43
▸ IL2 P60568 2/20 0.42
▸ RXFP1 Q9HBX9 1/20 0.42
▸ FLT1 P17948 3/20 0.41
▸ KDR P35968 2/20 0.41
▸ CYP1A2 P05177 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ F2 P00734 1/20 0.39
▸ F10 P00742 1/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ MAPT P10636 2/20 0.38
▸ AHR P35869 1/20 0.38
▸ EPAS1 Q99814 1/20 0.38
▸ PTGS2 P35354 1/20 0.38
▸ CRACR2A Q9BSW2 1/20 0.38

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
SCHEMBL16019806 0.90 RXFP1 (0.43) STIM1ORAI1IL2RXFP1FLT1
SCHEMBL14885665 0.89 STIM1 (0.50) STIM1ORAI1ORAI2IL2RXFP1
SCHEMBL16020152 0.85 STIM1 (0.43) STIM1ORAI1ORAI2IL2FLT1
SCHEMBL16020153 0.85 SMN1; SMN2 (0.43) STIM1ORAI1ORAI2IL2FLT1
SCHEMBL16020575 0.81 STIM1 (0.64) STIM1ORAI1ORAI2IL2RXFP1
SCHEMBL16019798 0.81 DGAT1 (0.46) STIM1ORAI1ORAI2IL2AHR
SCHEMBL16017260 0.79 PTGS2 (0.44) STIM1ORAI1ORAI2GAASMN1; SMN2
SCHEMBL16019817 0.79 SMN1; SMN2 (0.50) STIM1ORAI1ORAI2CYP1A2CYP2C9
SCHEMBL14887346 0.79 SMN1; SMN2 (0.44) STIM1ORAI1ORAI2RXFP1NPC1
SCHEMBL14887576 0.79 SCN10A (0.44) STIM1ORAI1ORAI2IL2KDR

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 STIM1 17/4885ORAI1 1/4885ORAI2 19/4885

“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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