SCHEMBL3376569

SCHEMBL3376569

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

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.48
ALDH1A1 P00352 1/20 0.48
MAPK1 P28482 2/20 0.43
NPSR1 Q6W5P4 2/20 0.42
TSHR P16473 1/20 0.42
HTT P42858 2/20 0.41
GAA P10253 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
POLB P06746 1/20 0.41
KMT2A Q03164 1/20 0.40
MCL1 Q07820 1/20 0.40
HCRTR2 O43614 2/20 0.39

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
SCHEMBL3378900 0.90 ALDH1A1 (0.55) RAB9AALDH1A1MAPK1TSHRSMN1; SMN2
SCHEMBL3375840 0.79 LMNA (0.45) RAB9AALDH1A1NPSR1TSHRHTT
SCHEMBL3376534 0.76 SMN1; SMN2 (0.60) RAB9AALDH1A1GAASMN1; SMN2KMT2A
SCHEMBL3378379 0.72 RAB9A (0.47) RAB9AALDH1A1MAPK1TSHRSMN1; SMN2
SCHEMBL3377097 0.71 LMNA (0.44) RAB9AALDH1A1SMN1; SMN2KMT2A
SCHEMBL3379013 0.69 ALDH1A1 (0.56) RAB9AALDH1A1MAPK1SMN1; SMN2KMT2A
SCHEMBL3382112 0.69 ALDH1A1 (0.48) RAB9AALDH1A1POLB
SCHEMBL3376946 0.68 CYP17A1 (0.51) ALDH1A1NPSR1TSHRHTTKMT2A
SCHEMBL13337348 0.68 ALDH1A1 (0.43) RAB9AALDH1A1SMN1; SMN2KMT2A
SCHEMBL3378975 0.68 ALDH1A1 (0.63) RAB9AALDH1A1SMN1; SMN2KMT2A

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 6 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
WO-2010056527-A2 FUSED HETEROCYCLIC COMPOUNDS AS ION CHANNEL MODULATORS GILEAD PALO ALTO, INC. (US) 2010-05-20 WO 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 RAB9A 1743/4885ALDH1A1 930/4885MAPK1 1122/4885

“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.