SCHEMBL1490517

SCHEMBL1490517

O=C(Nc1csc(-c2ccc(Br)cc2)c1C(=O)O)c1ccc(F)cc1Cl

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ANO1 Q5XXA6 8/20 0.47
▸ ANO2 Q9NQ90 1/20 0.44
▸ PYGL P06737 4/20 0.43
▸ GRM4 Q14833 1/20 0.42
▸ AVPR2 P30518 1/20 0.41
▸ OXTR P30559 1/20 0.41
▸ AVPR1A P37288 1/20 0.41
▸ RXFP1 Q9HBX9 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ NPC1 O15118 1/20 0.39
▸ GLA P06280 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ CTDSP1 Q9GZU7 1/20 0.39
▸ HPGD P15428 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
SCHEMBL1490458 0.91 ANO1 (0.55) ANO1ANO2PYGLGRM4
SCHEMBL12831284 0.89 ANO1 (0.56) ANO1NPC1RAB9A
SCHEMBL12756881 0.88 PPARG (0.49) ANO1KMT2ANPC1RAB9A
SCHEMBL12830932 0.88 ANO1 (0.43) ANO1ANO2KMT2ANPC1RAB9A
SCHEMBL1490673 0.86 ANO1 (0.45) ANO1ANO2KMT2AKDM4ENPC1
SCHEMBL12831006 0.84 MEN1 (0.53) ANO1KMT2ARAB9AHPGD
SCHEMBL1490568 0.82 MEN1 (0.49) KMT2ANPC1GLARAB9AHPGD
SCHEMBL3630195 0.81 ANO1 (0.71) ANO1ANO2KMT2ANPC1RAB9A
SCHEMBL12756890 0.81 PPARG (0.56) ANO1KMT2ANPC1RAB9A
SCHEMBL1490367 0.81 MEN1 (0.50) KMT2AKDM4ENPC1RAB9ANPSR1

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-8618307-B2 Compounds that modulate intracellular calcium CALCIMEDICA, INC. (US) 2013-12-31 — — US disclosed
EP-2477982-A2 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM Calcimedica, Inc. (US) 2012-07-25 — — EP 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

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 ANO1 114/4885ANO2 98/4885PYGL 1403/4885
US-20110065724-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM ORAI1, SARAF, RYR2 ANO1 114/4885ANO2 98/4885PYGL 1403/4885

“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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