SCHEMBL3379358

SCHEMBL3379358

COP(=O)(O)c1cc(-c2ccc(Oc3ccc(F)cc3)cc2)ccc1NS(C)(=O)=O

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 8/20 0.47
BCL2L1 Q07817 2/20 0.38
MCL1 Q07820 2/20 0.38
ALDH1A1 P00352 1/20 0.35
PGR P06401 3/20 0.35
NR3C1 P04150 2/20 0.35
NR3C2 P08235 2/20 0.35
AR P10275 2/20 0.35
MMP2 P08253 1/20 0.35
MMP9 P14780 1/20 0.35
KIF11 P52732 1/20 0.34
KDM1A O60341 1/20 0.34
MAOA P21397 1/20 0.34
STAT3 P40763 1/20 0.34
KIT P10721 1/20 0.34

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
SCHEMBL3376489 0.77 SCN9A (0.56) SCN9ABCL2L1MCL1PGRNR3C1
SCHEMBL3377241 0.67 TSHR (0.51) MCL1ALDH1A1PGR
SCHEMBL3314859 0.67 PGR (0.71) SCN9AALDH1A1PGRNR3C2AR
SCHEMBL3377340 0.66 PGR (0.56) MCL1PGRNR3C1NR3C2AR
SCHEMBL3377563 0.66 CYP2C9 (0.58) MCL1ALDH1A1PGR
SCHEMBL3375830 0.66 PGR (0.49) BCL2L1MCL1ALDH1A1PGRNR3C1
SCHEMBL6599365 0.65 PTGS2 (0.48) SCN9APGR
SCHEMBL3375889 0.65 PGR (0.55) SCN9ABCL2L1MCL1PGRNR3C1
SCHEMBL9657014 0.65 MRGPRX1 (0.51) SCN9AALDH1A1
SCHEMBL4575282 0.64 SOS1 (0.55) ALDH1A1

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 SCN9A 70/4885BCL2L1 2384/4885MCL1 3270/4885

“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.