SCHEMBL12155538

SCHEMBL12155538

Cc1cc2c(cc1-c1ccc(NC(=O)c3ccccc3)nc1)OC(F)(F)O2

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ STIM1 Q13586 2/20 0.57
▸ ORAI1 Q96D31 2/20 0.57
▸ ABL1 P00519 3/20 0.53
▸ HCAR3 P49019 1/20 0.48
▸ DEGS1 O15121 1/20 0.47
▸ ORAI2 Q96SN7 1/20 0.46
▸ RAB9A P51151 5/20 0.45
▸ NPC1 O15118 4/20 0.45
▸ SMN1; SMN2 Q16637 3/20 0.45
▸ MAPT P10636 1/20 0.45
▸ KMT2A Q03164 3/20 0.44
▸ PKM P14618 2/20 0.44
▸ MEN1 O00255 2/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ TP53 P04637 1/20 0.44
▸ HPGD P15428 1/20 0.44
▸ KDM4E B2RXH2 1/20 0.44

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
SCHEMBL12241544 0.91 STIM1 (0.54) STIM1ORAI1ABL1DEGS1ORAI2
SCHEMBL17244771 0.90 STIM1 (0.57) STIM1ORAI1ABL1ORAI2RAB9A
SCHEMBL12155518 0.88 STIM1 (0.56) STIM1ORAI1ABL1ORAI2RAB9A
SCHEMBL12155519 0.87 STIM1 (0.57) STIM1ORAI1ABL1HCAR3DEGS1
SCHEMBL1701825 0.86 STIM1 (0.62) STIM1ORAI1ABL1ORAI2RAB9A
SCHEMBL12155639 0.86 STIM1 (0.60) STIM1ORAI1ABL1HCAR3ORAI2
SCHEMBL1702582 0.85 STIM1 (0.53) STIM1ORAI1ABL1ORAI2RAB9A
SCHEMBL1701956 0.85 STIM1 (0.66) STIM1ORAI1ABL1ORAI2KMT2A
SCHEMBL16018236 0.84 STIM1 (0.50) STIM1ORAI1ABL1ORAI2MAPT
SCHEMBL16018235 0.83 STIM1 (0.53) STIM1ORAI1ABL1ORAI2RAB9A

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 11 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
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 1/4885ABL1 4066/4885
US-10703722-B2 Compounds that modulate intracellular calcium ORAI1, SARAF, RYR2 STIM1 17/4885ORAI1 1/4885ABL1 4066/4885
US-20110263612-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM ORAI1, SARAF, RYR2 STIM1 17/4885ORAI1 1/4885ABL1 4066/4885
US-20200317617-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM ORAI1, SARAF, RYR2 STIM1 17/4885ORAI1 1/4885ABL1 4066/4885

“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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