SCHEMBL12756809

SCHEMBL12756809

Cc1cccc(CCC(=O)Nc2csc(-c3ccc(Cl)nc3)c2C(=O)O)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 2/20 0.44
MAPK14 Q16539 1/20 0.41
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
RAB9A P51151 3/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HTT P42858 1/20 0.39
HSD17B10 Q99714 1/20 0.39
CDK8 P49336 1/20 0.38
MKNK1 Q9BUB5 1/20 0.38
POLB P06746 2/20 0.38
KDR P35968 1/20 0.37
PSEN1 P49768 1/20 0.37
PSEN2 P49810 1/20 0.37
APH1B Q8WW43 1/20 0.37
NCSTN Q92542 1/20 0.37
APH1A Q96BI3 1/20 0.37
PSENEN Q9NZ42 1/20 0.37
ALOX15 P16050 1/20 0.36
MAPK1 P28482 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
SCHEMBL15480664 0.90 HCAR2 (0.45) HCAR2MEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL12756808 0.90 HCAR2 (0.45) HCAR2MAPK14MEN1KMT2ARAB9A
SCHEMBL12756812 0.90 MEN1 (0.48) HCAR2MEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL12756628 0.88 HCAR2 (0.48) HCAR2MAPK14MEN1KMT2ARAB9A
SCHEMBL12414182 0.84 CASP3 (0.48) HCAR2MEN1KMT2ARAB9APOLB
SCHEMBL15479106 0.84 HCAR2 (0.48) HCAR2MAPK14MEN1KMT2ARAB9A
SCHEMBL12756811 0.82 CASP3 (0.48) MEN1KMT2ARAB9APOLBLMNA
SCHEMBL1490421 0.80 HCAR2 (0.46) HCAR2MEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL1490454 0.79 HCAR2 (0.50) HCAR2MEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL12756672 0.79 CNR1 (0.43) HCAR2MEN1KMT2ARAB9ASMN1; SMN2

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 HCAR2 343/4885MAPK14 2933/4885MEN1 2958/4885
US-20110065724-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM ORAI1, SARAF, RYR2 HCAR2 343/4885MAPK14 2933/4885MEN1 2958/4885

“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.