SCHEMBL3374058

SCHEMBL3374058

Cc1cc(CS(=O)(=O)NC(C)C(=O)OC(C)(C)C)ccc1-c1ccc(Oc2ccccc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ADAMTS4 O75173 2/20 0.41
ALOX5AP P20292 1/20 0.40
FEN1 P39748 1/20 0.40
ACACB O00763 2/20 0.40
ACACA Q13085 2/20 0.40
PPARG P37231 2/20 0.39
PPARA Q07869 2/20 0.39
PTGER4 P35408 1/20 0.38
MMP13 P45452 2/20 0.38
SCN9A Q15858 1/20 0.37
STS P08842 1/20 0.37
SRD5A2 P31213 1/20 0.36
DGAT1 O75907 1/20 0.36
HSP90AA1 P07900 1/20 0.36
HSP90AB1 P08238 1/20 0.36
PGR P06401 1/20 0.36
BTN3A1 O00481 1/20 0.36
MCL1 Q07820 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
SCHEMBL13337356 0.74 SMN1; SMN2 (0.48) ACACBACACAMMP13SCN9A
SCHEMBL3376158 0.72 SCN9A (0.39) PPARASCN9A
SCHEMBL3379986 0.70 CA12 (0.41) PPARAMMP13SRD5A2HSP90AA1HSP90AB1
SCHEMBL6741426 0.69 CTSB (0.43) ADAMTS4MMP13
SCHEMBL6741428 0.69 CTSB (0.43) ADAMTS4MMP13
SCHEMBL3376139 0.69 KMT2A (0.47) ACACBACACASRD5A2
SCHEMBL3376989 0.68 SMN1; SMN2 (0.54) PPARG
SCHEMBL3376558 0.68 PTGES (0.46) MCL1
SCHEMBL3376266 0.65 FEN1 (0.42) FEN1PTGER4
SCHEMBL789823 0.65 ADAMTS4 (0.54) ADAMTS4ALOX5APFEN1MMP13

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-8389500-B2 Fused heterocyclic compounds as ion channel modulators GILEAD SCIENCES, INC. (US) 2013-03-05 US claimed
WO-2010056527-A2 FUSED HETEROCYCLIC COMPOUNDS AS ION CHANNEL MODULATORS GILEAD PALO ALTO, INC. (US) 2010-05-20 WO claimed
US-20100113449-A1 FUSED HETEROCYCLIC COMPOUNDS AS ION CHANNEL MODULATORS GILEAD PALO ALTO, INC. (US) 2010-05-06 US claimed
US-8389500-B2 Fused heterocyclic compounds as ion channel modulators GILEAD SCIENCES, INC. (US) 2013-03-05 US disclosed
US-20100113449-A1 FUSED HETEROCYCLIC COMPOUNDS AS ION CHANNEL MODULATORS GILEAD PALO ALTO, INC. (US) 2010-05-06 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 (1 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-20100113449-A1 FUSED HETEROCYCLIC COMPOUNDS AS ION CHANNEL MODULATORS KCNJ2, HCN4, KCNH2 ADAMTS4 3615/4885ALOX5AP 1957/4885FEN1 4857/4885

“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.