SCHEMBL16636674

SCHEMBL16636674

Cc1nn(-c2cc(F)ccc2F)cc1-c1ccc(NC(=O)c2c(F)cccc2F)nc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IL2 P60568 5/20 0.49
SCN9A Q15858 2/20 0.46
ALDH1A1 P00352 3/20 0.43
RAB9A P51151 3/20 0.43
NPC1 O15118 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
PKM P14618 1/20 0.43
TSHR P16473 1/20 0.43
RIPK1 Q13546 1/20 0.42
ABL1 P00519 2/20 0.41
GRM5 P41594 3/20 0.41
RORC P51449 1/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
F10 P00742 1/20 0.40
KDM4E B2RXH2 1/20 0.39
TP53 P04637 1/20 0.39
GLA P06280 1/20 0.39
GAA P10253 1/20 0.39
HSD17B10 Q99714 1/20 0.39

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
SCHEMBL16636782 0.92 GRM5 (0.41) IL2SCN9AALDH1A1RAB9ANPC1
SCHEMBL16636903 0.91 SCN9A (0.50) IL2SCN9AALDH1A1RAB9ANPC1
SCHEMBL16636495 0.86 SCN9A (0.48) IL2SCN9AALDH1A1RAB9ANPC1
SCHEMBL16636757 0.86 IL2 (0.43) IL2SCN9AALDH1A1RAB9ANPC1
SCHEMBL16637360 0.85 SCN9A (0.47) IL2SCN9AALDH1A1RAB9ANPC1
SCHEMBL16636525 0.82 IL2 (0.46) IL2SCN9AALDH1A1RAB9ANPC1
SCHEMBL16636750 0.81 NPC1 (0.58) SCN9AALDH1A1RAB9ANPC1SMN1; SMN2
SCHEMBL16636428 0.81 IL2 (0.45) IL2SCN9AALDH1A1RAB9ANPC1
SCHEMBL16637889 0.79 IL2 (0.45) IL2SCN9AALDH1A1RAB9ANPC1
SCHEMBL16636531 0.77 IL2 (0.40) IL2SCN9ARAB9ANPC1ABL1

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 7 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-9611263-B2 Compounds that modulate intracellular calcium CALCIMEDICA, INC. (US) 2017-04-04 US disclosed
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
US-20160229845-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM AVENUE CAPITAL MANAGEMENT II, L.P. 2016-08-11 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 3716/4885SCN9A 235/4885ALDH1A1 4409/4885

“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.