SCHEMBL16637371

SCHEMBL16637371

Cc1cccc(F)c1C(=O)Nc1ccc(-c2cn(-c3nccs3)nc2C)cn1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IL2 P60568 9/20 0.43
STIM1 Q13586 2/20 0.42
ORAI1 Q96D31 2/20 0.42
ORAI2 Q96SN7 1/20 0.42
SCN9A Q15858 3/20 0.39
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
RAB9A P51151 3/20 0.36
NPC1 O15118 2/20 0.36
KDM4E B2RXH2 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
ALDH1A1 P00352 1/20 0.36
TP53 P04637 1/20 0.36
GLA P06280 1/20 0.36
GAA P10253 1/20 0.36
HSD17B10 Q99714 1/20 0.36
PKM P14618 1/20 0.36
ABL1 P00519 2/20 0.35
POLB P06746 1/20 0.35
TNF P01375 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
SCHEMBL16636428 0.95 IL2 (0.45) IL2STIM1ORAI1ORAI2SCN9A
SCHEMBL16636688 0.90 IL2 (0.44) IL2STIM1ORAI1MEN1KMT2A
SCHEMBL16636510 0.89 IL2 (0.37) IL2SCN9AMEN1KMT2ARAB9A
SCHEMBL16636634 0.89 STIM1 (0.53) IL2STIM1ORAI1ORAI2SCN9A
SCHEMBL16636863 0.87 IL2 (0.39) IL2SCN9ARAB9ANPC1KDM4E
SCHEMBL16636744 0.85 IL2 (0.48) IL2STIM1ORAI1MEN1KMT2A
SCHEMBL16636909 0.85 IL2 (0.42) IL2STIM1ORAI1SCN9AMEN1
SCHEMBL16636495 0.84 SCN9A (0.48) IL2STIM1ORAI1ORAI2SCN9A
SCHEMBL16636701 0.84 IL2 (0.42) IL2STIM1ORAI1SCN9AMEN1
SCHEMBL16636685 0.84 IL2 (0.48) IL2STIM1ORAI1ORAI2SCN9A

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-9611263-B2 Compounds that modulate intracellular calcium CALCIMEDICA, INC. (US) 2017-04-04 US disclosed
US-20160229845-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM AVENUE CAPITAL MANAGEMENT II, L.P. 2016-08-11 US disclosed
WO-2015054283-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM CALCIMEDICA, INC. (US) 2015-04-16 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-20160229845-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM ORAI1, SARAF, RYR2 IL2 3716/4885STIM1 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.