SCHEMBL3379013

SCHEMBL3379013

CC(C)(C)OC(=O)CN(c1ccc(-c2ccc(F)c(Cl)c2)c(Cl)c1)S(C)(=O)=O

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.56
KMT2A Q03164 1/20 0.48
RAB9A P51151 1/20 0.48
MAPT P10636 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.43
PTGS2 P35354 3/20 0.40
APP P05067 1/20 0.39
LMNA P02545 1/20 0.39
KDM4E B2RXH2 1/20 0.39
MAPK1 P28482 1/20 0.37
PTGDR2 Q9Y5Y4 1/20 0.37

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
SCHEMBL3378975 0.85 ALDH1A1 (0.63) ALDH1A1KMT2ARAB9AMAPTSMN1; SMN2
SCHEMBL3378900 0.78 ALDH1A1 (0.55) ALDH1A1KMT2ARAB9AMAPTSMN1; SMN2
SCHEMBL3376534 0.76 SMN1; SMN2 (0.60) ALDH1A1KMT2ARAB9AMAPTSMN1; SMN2
SCHEMBL3375789 0.75 POLB (0.38) ALDH1A1RAB9AMAPTSMN1; SMN2PTGS2
SCHEMBL3379527 0.72 ALDH1A1 (0.41) ALDH1A1RAB9AMAPTPTGS2LMNA
SCHEMBL3374842 0.71 SMN1; SMN2 (0.59) ALDH1A1RAB9AMAPTSMN1; SMN2LMNA
SCHEMBL3376989 0.71 SMN1; SMN2 (0.54) ALDH1A1KMT2ARAB9AMAPTSMN1; SMN2
SCHEMBL24279552 0.70 MAPT (0.50) ALDH1A1RAB9AMAPTSMN1; SMN2LMNA
SCHEMBL8302189 0.70 SMN1; SMN2 (0.46) ALDH1A1KMT2ARAB9AMAPTSMN1; SMN2
SCHEMBL3378379 0.70 RAB9A (0.47) ALDH1A1KMT2ARAB9AMAPTSMN1; SMN2

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 ALDH1A1 930/4885KMT2A 3186/4885RAB9A 1743/4885

“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.