SCHEMBL16572603

SCHEMBL16572603

Cc1cc2c(cc1-c1ccc(NC(=O)c3c(F)cncc3F)nc1)C(F)(F)CC2

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ IL2 P60568 4/20 0.44
▸ STIM1 Q13586 1/20 0.41
▸ ORAI1 Q96D31 1/20 0.41
▸ ABL1 P00519 13/20 0.38
▸ ALDH1A1 P00352 1/20 0.36
▸ CYP2C9 P11712 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ NPC1 O15118 1/20 0.35
▸ RAB9A P51151 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
SCHEMBL12241721 0.92 IL2 (0.53) IL2STIM1ORAI1ABL1ALDH1A1
SCHEMBL12241732 0.86 IL2 (0.51) IL2STIM1ORAI1ABL1
SCHEMBL12241722 0.85 NPC1 (0.54) IL2STIM1ORAI1ABL1ALDH1A1
SCHEMBL12156310 0.84 IL2 (0.47) IL2STIM1ORAI1ABL1ALDH1A1
SCHEMBL12241719 0.83 NPC1 (0.50) IL2STIM1ORAI1ABL1ALDH1A1
SCHEMBL12241729 0.82 ABL1 (0.48) STIM1ORAI1ABL1ALDH1A1CYP2C19
SCHEMBL12241727 0.80 IL2 (0.54) IL2STIM1ORAI1
SCHEMBL12155680 0.78 STIM1 (0.47) IL2STIM1ORAI1ABL1ALDH1A1
SCHEMBL12155836 0.78 IL2 (0.53) IL2STIM1ORAI1ABL1ALDH1A1
SCHEMBL16572573 0.78 IL2 (0.46) IL2STIM1ORAI1ABL1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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

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-10703722-B2 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.

Send feedback