SCHEMBL12155543

SCHEMBL12155543

Cn1nc(-c2ccccc2F)cc1-c1ccc(NC(=O)c2ccccc2Cl)nc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ STIM1 Q13586 2/20 0.56
▸ ORAI1 Q96D31 2/20 0.56
▸ SMN1; SMN2 Q16637 5/20 0.47
▸ TDP1 Q9NUW8 1/20 0.47
▸ DYRK1A Q13627 5/20 0.47
▸ GSK3B P49841 3/20 0.47
▸ TP53 P04637 3/20 0.45
▸ NPC1 O15118 3/20 0.45
▸ RAB9A P51151 3/20 0.45
▸ ALDH1A1 P00352 2/20 0.45
▸ GAA P10253 2/20 0.45
▸ KDM4E B2RXH2 1/20 0.45
▸ GLA P06280 1/20 0.45
▸ HSD17B10 Q99714 1/20 0.45
▸ LMNA P02545 2/20 0.44
▸ ABL1 P00519 1/20 0.44
▸ TSHR P16473 1/20 0.43
▸ PTBP1 P26599 1/20 0.43
▸ WNT1 P04628 1/20 0.43
▸ MEN1 O00255 1/20 0.42

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
SCHEMBL12155573 0.92 STIM1 (0.65) STIM1ORAI1SMN1; SMN2TDP1DYRK1A
SCHEMBL12156004 0.87 SMN1; SMN2 (0.52) STIM1ORAI1SMN1; SMN2DYRK1AGSK3B
SCHEMBL12155539 0.86 STIM1 (0.52) STIM1ORAI1SMN1; SMN2TP53NPC1
SCHEMBL12156191 0.86 STIM1 (0.57) STIM1ORAI1SMN1; SMN2TDP1DYRK1A
SCHEMBL12155588 0.83 STIM1 (0.54) STIM1ORAI1SMN1; SMN2TDP1DYRK1A
SCHEMBL12156008 0.83 STIM1 (0.66) STIM1ORAI1SMN1; SMN2TDP1DYRK1A
SCHEMBL12156202 0.82 STIM1 (0.55) STIM1ORAI1SMN1; SMN2TDP1DYRK1A
SCHEMBL12155524 0.82 KDM4E (0.52) STIM1ORAI1SMN1; SMN2DYRK1AGSK3B
SCHEMBL12155529 0.82 RAB9A (0.52) SMN1; SMN2DYRK1AGSK3BTP53NPC1
SCHEMBL12156172 0.82 STIM1 (0.53) STIM1ORAI1SMN1; SMN2DYRK1AGSK3B

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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200317617-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM AVENUE CAPITAL MANAGEMENT II, L.P. 2020-10-08 — — US disclosed
US-10703722-B2 Compounds that modulate intracellular calcium CALCIMEDICA, INC. (US) 2020-07-07 — — US disclosed
EP-2563776-B1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM CALCIMEDICA INC (US) 2016-06-08 — — EP disclosed
US-20150322012-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM AVENUE CAPITAL MANAGEMENT II, L.P. 2015-11-12 — — US disclosed
US-9120751-B2 Compounds that modulate intracellular calcium CALCIMEDICA, INC. (US) 2015-09-01 — — US disclosed
US-9120751-B2 Compounds that modulate intracellular calcium CALCIMEDICA, INC. (US) 2015-09-01 — — US disclosed
US-8980629-B2 Compounds that modulate intracellular calcium CALCIMEDICA, INC. (US) 2015-03-17 — — US disclosed
US-8980629-B2 Compounds that modulate intracellular calcium CALCIMEDICA, INC. (US) 2015-03-17 — — US disclosed
US-8546403-B2 Compounds that modulate intracellular calcium CALCIMEDICA, INC. (US) 2013-10-01 — — US disclosed
WO-2011139489-A2 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM CALCIMEDICA INC. (US) 2011-11-10 — — WO disclosed
US-20110263612-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM CALCIMEDICA, INC. (US) 2011-10-27 — — US disclosed
US-20110263612-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM CALCIMEDICA, INC. (US) 2011-10-27 — — US 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 (4 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-20150322012-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM ORAI1, SARAF, RYR2 STIM1 17/4885ORAI1 1/4885SMN1; SMN2 854/4885
US-10703722-B2 Compounds that modulate intracellular calcium ORAI1, SARAF, RYR2 STIM1 17/4885ORAI1 1/4885SMN1; SMN2 854/4885
US-20110263612-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM ORAI1, SARAF, RYR2 STIM1 17/4885ORAI1 1/4885SMN1; SMN2 854/4885
US-20200317617-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM ORAI1, SARAF, RYR2 STIM1 17/4885ORAI1 1/4885SMN1; SMN2 854/4885

“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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