SCHEMBL14887335

SCHEMBL14887335

Cc1nc(C(=O)Nc2ccc(-c3cc4c(cc3Cl)OC(F)(F)O4)cc2)c(C)o1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 9/20 0.42
▸ STIM1 Q13586 3/20 0.42
▸ ORAI1 Q96D31 3/20 0.42
▸ ORAI2 Q96SN7 1/20 0.42
▸ BACE2 Q9Y5Z0 4/20 0.40
▸ KDM4E B2RXH2 2/20 0.40
▸ GAA P10253 2/20 0.40
▸ SSTR2 P30874 1/20 0.38
▸ SMO Q99835 1/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ IL2 P60568 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL14887339 0.90 BACE1 (0.44) BACE1STIM1ORAI1BACE2KDM4E
SCHEMBL16019798 0.88 DGAT1 (0.46) STIM1ORAI1ORAI2SMOIL2
SCHEMBL14885575 0.88 STIM1 (0.49) BACE1STIM1ORAI1ORAI2KDM4E
SCHEMBL16017234 0.87 HSD17B10 (0.50) STIM1ORAI1ORAI2NPC1RAB9A
SCHEMBL14887346 0.84 SMN1; SMN2 (0.44) STIM1ORAI1ORAI2NPC1RAB9A
SCHEMBL16019781 0.84 KDM4E (0.58) STIM1ORAI1ORAI2KDM4ENPC1
SCHEMBL16019776 0.82 ALDH1A1 (0.56) STIM1ORAI1ORAI2KDM4ENPC1
SCHEMBL16019778 0.82 GRM1 (0.49) STIM1ORAI1ORAI2KDM4ENPC1
SCHEMBL16017213 0.80 GRM1 (0.48) KDM4EGAANPC1RAB9ASMN1; SMN2
SCHEMBL14885577 0.80 STIM1 (0.62) BACE1STIM1ORAI1ORAI2BACE2

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-20140256771-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM CALCIMEDICA, INC. 2014-09-11 — — US disclosed
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 BACE1 677/4885STIM1 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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