SCHEMBL12756314

SCHEMBL12756314

Cc1cc(F)c2nc(C(=O)Nc3csc(-c4ccc(Cl)cc4)c3C(=O)O)oc2c1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ANO1 Q5XXA6 12/20 0.39
▸ DHODH Q02127 3/20 0.37
▸ ANO2 Q9NQ90 1/20 0.37
▸ THRB P10828 1/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ TP53 P04637 1/20 0.33
▸ RXFP1 Q9HBX9 1/20 0.33
▸ PTGFR P43088 1/20 0.33

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
SCHEMBL12830946 0.91 THRB (0.40) ANO1DHODHANO2THRB
SCHEMBL12756319 0.86 ANO1 (0.38) ANO1ANO2THRBMEN1KMT2A
SCHEMBL12270901 0.84 ANO1 (0.59) ANO1ANO2MEN1KMT2A
SCHEMBL12756328 0.83 ANO1 (0.37) ANO1DHODHRXFP1
SCHEMBL12831073 0.81 ANO1 (0.43) ANO1DHODHANO2THRBTP53
SCHEMBL15480680 0.81 DHODH (0.44) ANO1DHODHANO2THRB
SCHEMBL12831071 0.80 MAPT (0.43) ANO1THRBMEN1KMT2ATP53
SCHEMBL12756310 0.80 ANO1 (0.38) ANO1DHODHMEN1KMT2ATP53
SCHEMBL12756301 0.79 ABL1 (0.41) ANO1MEN1KMT2A
SCHEMBL12830017 0.78 KDM4E (0.45) ANO1MEN1KMT2ATP53

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 2 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-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 114/4885DHODH 2153/4885ANO2 98/4885
US-20110065724-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM ORAI1, SARAF, RYR2 ANO1 114/4885DHODH 2153/4885ANO2 98/4885

“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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