SCHEMBL3627300

SCHEMBL3627300

CCOC(=O)c1c(-c2ccc(Cl)cc2)csc1NC(=O)c1ccc(F)cc1

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.72
TP53 P04637 4/20 0.67
THRB P10828 2/20 0.67
PTPN1 P18031 3/20 0.66
MEN1 O00255 2/20 0.62
KMT2A Q03164 2/20 0.62
NPC1 O15118 1/20 0.62
RAB9A P51151 1/20 0.62
ALDH1A1 P00352 5/20 0.60
KDM4E B2RXH2 3/20 0.60
HPGD P15428 3/20 0.60
SMN1; SMN2 Q16637 2/20 0.60
LMNA P02545 1/20 0.60
GAA P10253 1/20 0.60
PTPRC P08575 2/20 0.59
PTPN2 P17706 2/20 0.59
PTPA Q15257 2/20 0.59
POLB P06746 1/20 0.59
TDP1 Q9NUW8 1/20 0.59
L3MBTL1 Q9Y468 1/20 0.59

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
SCHEMBL3629109 1.00 MAPT (0.72) MAPTTP53THRBPTPN1MEN1
SCHEMBL3620747 0.90 THRB (0.80) MAPTTP53THRBPTPN1MEN1
SCHEMBL21247385 0.89 TP53 (0.72) MAPTTP53THRBPTPN1MEN1
SCHEMBL3631128 0.89 MAPT (0.66) MAPTTP53THRBMEN1KMT2A
SCHEMBL3629358 0.88 THRB (0.63) MAPTTP53THRBPTPN1MEN1
SCHEMBL13837701 0.86 ANO1 (0.73) MAPTTP53PTPN1PTPRCPTPN2
SCHEMBL3629702 0.84 TP53 (0.82) MAPTTP53PTPN1MEN1KMT2A
SCHEMBL8289507 0.83 PTPN1 (0.69) MAPTTP53THRBPTPN1MEN1
SCHEMBL3629623 0.83 MEN1 (0.80) TP53MEN1KMT2ANPC1RAB9A
SCHEMBL3628382 0.83 MEN1 (0.80) TP53MEN1KMT2ANPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8524765-B2 Compounds that modulate intracellular calcium CALCIMEDICA, INC. (US) 2013-09-03 US disclosed
US-20120289587-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM CALCIMEDICA, INC. (US) 2012-11-15 US disclosed
US-8263641-B2 Compounds that modulate intracellular calcium CALCIMEDICA, INC. (US) 2012-09-11 US disclosed
EP-2200607-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM Calcimedica, Inc. (US) 2010-06-30 EP disclosed
US-20090137659-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM CALCIMEDICA, INC. (US) 2009-05-28 US disclosed
WO-2009035818-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM CALCIMEDICA, INC. (US) 2009-03-19 WO 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-20120289587-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM ORAI1, SARAF, RYR2 MAPT 1478/4885TP53 2681/4885THRB 1606/4885
US-20090137659-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM ORAI1, SARAF, RYR2 MAPT 1478/4885TP53 2681/4885THRB 1606/4885

“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.