SCHEMBL12756752

SCHEMBL12756752

O=C(O)c1c(NC(=O)N2Cc3ccccc3C2)csc1-c1ccc(Cl)cc1

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ TAS1R3 Q7RTX0 9/20 0.54
▸ TAS1R1 Q7RTX1 9/20 0.54
▸ TAS1R2 Q8TE23 9/20 0.54
▸ MEN1 O00255 1/20 0.46
▸ GAA P10253 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ HDAC2 Q92769 1/20 0.45
▸ NAMPT P43490 10/20 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
SCHEMBL12830437 0.93 KMT2A (0.58) TAS1R3TAS1R1TAS1R2MEN1GAA
SCHEMBL12756762 0.89 NPC1 (0.46) TAS1R3TAS1R1TAS1R2NAMPT
SCHEMBL12756747 0.87 HDAC2 (0.46) TAS1R3TAS1R1TAS1R2HDAC2NAMPT
SCHEMBL12830435 0.86 HDAC2 (0.42) TAS1R3TAS1R1TAS1R2MEN1GAA
SCHEMBL12756750 0.82 RAB9A (0.58) TAS1R3TAS1R1TAS1R2
SCHEMBL1895278 0.80 ANO1 (0.60) TAS1R3TAS1R1TAS1R2MEN1KMT2A
SCHEMBL12756737 0.80 NPY5R (0.48) MEN1KMT2AHDAC2
SCHEMBL12756545 0.78 ANO1 (0.49) MEN1KMT2A
SCHEMBL12756744 0.77 P2RX7 (0.40) MEN1KMT2A
SCHEMBL12830909 0.76 ANO1 (0.38) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140051711-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM CALCIMEDICA INC. (US) 2014-02-20 — — US disclosed
US-20140051711-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM CALCIMEDICA INC. (US) 2014-02-20 — — US disclosed
WO-2011034962-A2 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM CALCIMEDICA INC. (US) 2011-03-24 — — WO disclosed
US-20110065724-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM CALCIMEDICA, INC. (US) 2011-03-17 — — US disclosed
US-20110065724-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM CALCIMEDICA, INC. (US) 2011-03-17 — — 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 (2 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-20140051711-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM ORAI1, SARAF, RYR2 TAS1R3 3820/4885TAS1R1 3836/4885TAS1R2 3547/4885
US-20110065724-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM ORAI1, SARAF, RYR2 TAS1R3 3820/4885TAS1R1 3836/4885TAS1R2 3547/4885

“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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