SCHEMBL5367845

SCHEMBL5367845

Nc1ccc(SCc2cccc(OC(F)(F)F)c2)cc1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.46
MEN1 O00255 1/20 0.43
NPC1 O15118 1/20 0.43
ALDH1A1 P00352 1/20 0.43
RAB9A P51151 1/20 0.43
KMT2A Q03164 1/20 0.43
CETP P11597 3/20 0.42
KIF11 P52732 1/20 0.42
CHRM2 P08172 1/20 0.41
CHRM1 P11229 1/20 0.41
CHRM3 P20309 1/20 0.41
MPO P05164 1/20 0.41
DAO P14920 1/20 0.40
MAOB P27338 2/20 0.40
CXCR2 P25025 1/20 0.39
HCRTR1 O43613 1/20 0.38
HCRTR2 O43614 1/20 0.38
SCN9A Q15858 1/20 0.38
GRIN2B Q13224 1/20 0.38

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
SCHEMBL5377066 0.82 ALDH1A1 (0.56) EPHX1MEN1NPC1ALDH1A1RAB9A
SCHEMBL13581190 0.82 ALDH1A1 (0.56) EPHX1MEN1NPC1ALDH1A1RAB9A
SCHEMBL5373730 0.79 ALDH1A1 (0.52) MEN1NPC1ALDH1A1RAB9AKMT2A
SCHEMBL5371939 0.78 MAOB (0.56) EPHX1MEN1NPC1ALDH1A1RAB9A
SCHEMBL4339672 0.75 NPC1 (0.58) MEN1NPC1ALDH1A1RAB9AKMT2A
SCHEMBL5526402 0.75 CHRM2 (0.50) EPHX1CETPCHRM2CHRM1CHRM3
SCHEMBL5526398 0.75 EPHX1 (0.48) EPHX1CETPKIF11CHRM2CHRM1
SCHEMBL6054525 0.75 CETP (0.43) EPHX1CETPCHRM2CHRM1CHRM3
SCHEMBL22232531 0.74 MPO (0.51) CETPKIF11CHRM2CHRM1CHRM3
SCHEMBL1095907 0.73 TAAR1 (0.61) CETPKIF11CHRM2CHRM1CHRM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7262318-B2 Substituted heteroaryl- and phenylsulfamoyl compounds PFIZER, INC. (US) 2007-08-28 US disclosed
CN-1930121-A Substituted heteroaryl- and phenylsulfamoyl compounds PFIZER PROD INC (US) 2007-03-14 CN disclosed
US-20050228015-A1 Substituted heteroaryl- and phenylsulfamoyl compounds PFIZER INC 2005-10-13 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-20050228015-A1 Substituted heteroaryl- and phenylsulfamoyl compounds PPARA, PPARG, PPARD EPHX1 2407/4885MEN1 4855/4885NPC1 59/4885

“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.