SCHEMBL1490241

SCHEMBL1490241

O=C(CCc1ccccc1)Nc1csc(-c2ccc(Cl)cc2)c1C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.53
MAPK1 P28482 1/20 0.53
SMN1; SMN2 Q16637 3/20 0.49
HCAR2 Q8TDS4 6/20 0.48
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
LMNA P02545 1/20 0.47
TSHR P16473 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
RAB9A P51151 3/20 0.46
NPC1 O15118 2/20 0.46
MALT1 Q9UDY8 1/20 0.45
MAPT P10636 1/20 0.45
HTT P42858 1/20 0.45
HPGD P15428 2/20 0.44
KDM6B O15054 1/20 0.44
KDM4D Q6B0I6 1/20 0.44
KDM4C Q9H3R0 1/20 0.44
EGLN3 Q9H6Z9 1/20 0.44

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
SCHEMBL1490370 0.95 HCAR2 (0.47) ALOX15MAPK1SMN1; SMN2HCAR2MEN1
SCHEMBL12756631 0.93 NPY5R (0.51) ALOX15MAPK1SMN1; SMN2HCAR2MEN1
SCHEMBL12756660 0.92 HDAC1 (0.48) ALOX15MAPK1SMN1; SMN2MEN1KMT2A
SCHEMBL1490454 0.91 HCAR2 (0.50) ALOX15MAPK1SMN1; SMN2HCAR2MEN1
SCHEMBL1490677 0.90 HCAR2 (0.53) ALOX15MAPK1SMN1; SMN2HCAR2RAB9A
SCHEMBL12756626 0.90 RAB9A (0.44) ALOX15MAPK1SMN1; SMN2HCAR2MEN1
SCHEMBL1490512 0.90 ALOX15 (0.52) ALOX15MAPK1SMN1; SMN2HCAR2MEN1
SCHEMBL12756640 0.89 HCAR2 (0.59) SMN1; SMN2HCAR2RAB9ANPC1MAPT
SCHEMBL12756649 0.89 HCAR2 (0.43) ALOX15MAPK1SMN1; SMN2HCAR2MEN1
SCHEMBL12756628 0.88 HCAR2 (0.48) ALOX15MAPK1SMN1; SMN2HCAR2MEN1

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 10 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-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
US-20110065724-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM CALCIMEDICA, INC. (US) 2011-03-17 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 ALOX15 1014/4885MAPK1 2526/4885SMN1; SMN2 854/4885
US-20110065724-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM ORAI1, SARAF, RYR2 ALOX15 1014/4885MAPK1 2526/4885SMN1; SMN2 854/4885

“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.