SCHEMBL14239589

SCHEMBL14239589

Cc1cc(OC(F)(F)F)ccc1-c1cnc(NCc2ccccc2F)s1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CSNK2A2 P19784 1/20 0.42
▸ CSNK2A1 P68400 1/20 0.42
▸ MAPK14 Q16539 4/20 0.40
▸ LIMK1 P53667 4/20 0.40
▸ MAPT P10636 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ FFAR4 Q5NUL3 1/20 0.38
▸ CYP1A2 P05177 2/20 0.37
▸ CHRM5 P08912 1/20 0.37
▸ ALOX5AP P20292 1/20 0.36
▸ FEN1 P39748 1/20 0.36
▸ CSNK1D P48730 1/20 0.36
▸ MAOB P27338 1/20 0.36
▸ TRPV1 Q8NER1 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
SCHEMBL14239590 0.89 STIM1 (0.40) CSNK2A2CSNK2A1MAPK14LIMK1MAPT
SCHEMBL14999205 0.84 MAPT (0.46) CSNK2A2CSNK2A1MAPK14LIMK1MAPT
SCHEMBL14239144 0.82 ESR2 (0.45) CSNK2A2CSNK2A1MAPK14LIMK1MAPT
SCHEMBL14999203 0.78 LIMK1 (0.48) CSNK2A2CSNK2A1MAPK14LIMK1MAPT
SCHEMBL14239588 0.76 MEN1 (0.40) CSNK2A2CSNK2A1MAPK14LIMK1MAPT
SCHEMBL14999206 0.76 STIM1 (0.52) CSNK2A2CSNK2A1MAPK14LIMK1MEN1
SCHEMBL14999204 0.72 KDM4E (0.49) MAPK14LIMK1MAPTMEN1KMT2A
SCHEMBL14239143 0.70 ESR2 (0.46) MAPK14LIMK1MAPTMEN1KMT2A
SCHEMBL14999199 0.70 STIM1 (0.46) MAPK14MEN1KMT2A
SCHEMBL14158766 0.69 STIM1 (0.52) RAB9A

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-20130143927-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM CALCIMEDICA, INC. (US) 2013-06-06 — — US disclosed
WO-2012170951-A2 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM CALCIMEDICA, INC. (US) 2012-12-13 — — 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-20130143927-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM ORAI1, SARAF, RYR2 CSNK2A2 1318/4885CSNK2A1 1647/4885MAPK14 2933/4885

“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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