SCHEMBL1490404

SCHEMBL1490404

COC(=O)c1c(NC(=O)c2cc(F)ccc2O)csc1-c1ccc(C)cc1F

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.43
TAS1R3 Q7RTX0 1/20 0.43
TAS1R1 Q7RTX1 1/20 0.43
TAS1R2 Q8TE23 1/20 0.43
LMNA P02545 1/20 0.43
POLB P06746 1/20 0.43
KCNMA1 Q12791 5/20 0.41
P2RX1 P51575 3/20 0.39
TMPRSS4 Q9NRS4 2/20 0.39
F10 P00742 1/20 0.37
ALDH1A1 P00352 1/20 0.37
NPC1 O15118 2/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
GRM5 P41594 1/20 0.36
TP53 P04637 1/20 0.36
GAA P10253 1/20 0.36
RAB9A P51151 1/20 0.36
MRGPRX1 Q96LB2 1/20 0.36

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
SCHEMBL1490228 0.90 TAS1R3 (0.45) TAS1R3TAS1R1TAS1R2LMNAKCNMA1
SCHEMBL12756909 0.86 GAA (0.45) TAS1R3TAS1R1TAS1R2LMNAKCNMA1
SCHEMBL15480673 0.82 KCNMA1 (0.55) MAPTLMNAPOLBKCNMA1F10
SCHEMBL1490251 0.78 KCNMA1 (0.46) MAPTTAS1R3TAS1R1TAS1R2LMNA
SCHEMBL12756907 0.76 LMNA (0.42) TAS1R3TAS1R1TAS1R2LMNAKCNMA1
SCHEMBL1490543 0.76 TAS1R3 (0.42) MAPTTAS1R3TAS1R1TAS1R2LMNA
SCHEMBL6926060 0.75 ANO1 (0.56) NPC1MEN1KMT2ARAB9A
SCHEMBL14363404 0.74 TAS1R3 (0.60) MAPTTAS1R3TAS1R1TAS1R2LMNA
SCHEMBL1490539 0.74 ALDH1A1 (0.47) MAPTLMNAPOLBALDH1A1MEN1
SCHEMBL24460185 0.71 KCNMA1 (0.56) MAPTTAS1R3TAS1R1TAS1R2LMNA

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 7 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
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
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 MAPT 1478/4885TAS1R3 3820/4885TAS1R1 3836/4885
US-20110065724-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM ORAI1, SARAF, RYR2 MAPT 1478/4885TAS1R3 3820/4885TAS1R1 3836/4885

“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.