SCHEMBL4108484

SCHEMBL4108484

Cc1cccc(C(=O)Nc2scc(-c3ccc(Cl)cc3)c2C(=O)O)c1

nearest known ligand 0.80

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CASP3 P42574 1/20 0.80
SENP8 Q96LD8 1/20 0.80
SENP7 Q9BQF6 1/20 0.80
SENP6 Q9GZR1 1/20 0.80
ANO1 Q5XXA6 14/20 0.70
MEN1 O00255 4/20 0.60
KMT2A Q03164 4/20 0.60
ALDH1A1 P00352 1/20 0.60
LMNA P02545 1/20 0.60
HPGD P15428 1/20 0.60
GFER P55789 1/20 0.60
NPC1 O15118 2/20 0.59
RAB9A P51151 2/20 0.59
ANO2 Q9NQ90 1/20 0.59
GRIN2C Q14957 1/20 0.58

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
SCHEMBL4114544 0.92 CASP3 (0.85) CASP3SENP8SENP7SENP6ANO1
SCHEMBL3628774 0.91 CASP3 (0.83) CASP3SENP8SENP7SENP6ANO1
SCHEMBL4124608 0.90 CASP3 (0.72) CASP3SENP8SENP7SENP6ANO1
SCHEMBL13926174 0.90 ANO1 (0.72) CASP3SENP8SENP7SENP6ANO1
SCHEMBL4129079 0.89 CASP3 (0.80) CASP3SENP8SENP7SENP6ANO1
SCHEMBL3628387 0.89 CASP3 (1.00) CASP3SENP8SENP7SENP6ANO1
SCHEMBL15233170 0.88 CASP3 (0.71) CASP3SENP8SENP7SENP6ANO1
SCHEMBL12414185 0.87 CASP3 (0.71) CASP3SENP8SENP7SENP6ANO1
SCHEMBL12271278 0.87 ANO1 (0.80) ANO1MEN1KMT2ARAB9AANO2
SCHEMBL3631055 0.87 CASP3 (0.64) CASP3SENP8SENP7SENP6ANO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8263641-B2 Compounds that modulate intracellular calcium CALCIMEDICA, INC. (US) 2012-09-11 US claimed
US-20090137659-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM CALCIMEDICA, INC. (US) 2009-05-28 US claimed
US-9234165-B2 Low-VOC cleaning substrates and compositions consisting of a solvent mixture THE CLOROX COMPANY (US) 2016-01-12 US disclosed
US-9006165-B2 Low-VOC cleaning substrates and compositions comprising a cationic biocide and glycol ether solvent THE CLOROX COMPANY (US) 2015-04-14 US disclosed
US-20150079140-A1 LOW-VOC CLEANING SUBSTRATES AND COMPOSITIONS THE CLOROX COMPANY (US) 2015-03-19 US disclosed
US-20140150193-A1 LOW-VOC CLEANING SUBSTRATES AND COMPOSITIONS THE CLOROX COMPANY (US) 2014-06-05 US disclosed
US-8524765-B2 Compounds that modulate intracellular calcium CALCIMEDICA, INC. (US) 2013-09-03 US disclosed
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-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
US-20090246240-A1 DRY BACTERICIDAL NONWOVEN WIPE TWIN BROOK CAPITAL PARTNERS, LLC 2009-10-01 US disclosed
US-20090137659-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM CALCIMEDICA, INC. (US) 2009-05-28 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 (3 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 CASP3 2232/4885SENP8 3756/4885SENP7 3940/4885
US-20150079140-A1 LOW-VOC CLEANING SUBSTRATES AND COMPOSITIONS VCL, SMURF1, SMURF2 CASP3 2191/4885SENP8 1393/4885SENP7 431/4885
US-20090137659-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM ORAI1, SARAF, RYR2 CASP3 2232/4885SENP8 3756/4885SENP7 3940/4885

“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.