SCHEMBL1490370

SCHEMBL1490370

O=C(CCc1ccc(Cl)cc1)Nc1csc(-c2ccc(Cl)cc2)c1C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 11/20 0.47
ALOX15 P16050 1/20 0.46
MAPK1 P28482 1/20 0.46
HDAC1 Q13547 3/20 0.46
HDAC6 Q9UBN7 3/20 0.46
TRPV1 Q8NER1 2/20 0.44
CHRM1 P11229 1/20 0.44
HTR2A P28223 1/20 0.44
MCHR1 Q99705 1/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HDAC3 O15379 1/20 0.41
HDAC4 P56524 1/20 0.41
HDAC7 Q8WUI4 1/20 0.41
HDAC2 Q92769 1/20 0.41
HDAC10 Q969S8 1/20 0.41
HDAC11 Q96DB2 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
HDAC9 Q9UKV0 1/20 0.41

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
SCHEMBL1490241 0.95 ALOX15 (0.53) HCAR2ALOX15MAPK1MEN1KMT2A
SCHEMBL1490677 0.94 HCAR2 (0.53) HCAR2ALOX15MAPK1HDAC1HDAC6
SCHEMBL12756626 0.94 RAB9A (0.44) HCAR2ALOX15MAPK1HDAC1HDAC6
SCHEMBL1490812 0.90 HDAC1 (0.43) HCAR2ALOX15MAPK1HDAC1HDAC6
SCHEMBL1490454 0.89 HCAR2 (0.50) HCAR2ALOX15MAPK1TRPV1MEN1
SCHEMBL12756631 0.89 NPY5R (0.51) HCAR2ALOX15MAPK1HDAC1HDAC6
SCHEMBL12756660 0.88 HDAC1 (0.48) ALOX15MAPK1HDAC1HDAC6MEN1
SCHEMBL12756637 0.88 RAB9A (0.43) HCAR2ALOX15MAPK1TRPV1SMN1; SMN2
SCHEMBL15479094 0.87 RAB9A (0.42) HCAR2ALOX15MAPK1KMT2ASMN1; SMN2
SCHEMBL12756646 0.86 ANO1 (0.45) HCAR2ALOX15MAPK1TRPV1MEN1

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 HCAR2 343/4885ALOX15 1014/4885MAPK1 2526/4885
US-20110065724-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM ORAI1, SARAF, RYR2 HCAR2 343/4885ALOX15 1014/4885MAPK1 2526/4885

“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.