SCHEMBL4757467

SCHEMBL4757467

CC(=O)Oc1c(C(=O)Nc2ncc(NS(C)(=O)=O)s2)ccc(C)c1C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 6/20 0.39
RAB9A P51151 6/20 0.39
ALDH1A1 P00352 4/20 0.39
STAT3 P40763 4/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
LMNA P02545 2/20 0.39
PKM P14618 2/20 0.39
MAPT P10636 2/20 0.39
MLNR O43193 1/20 0.39
NR1I2 O75469 1/20 0.39
ABCB11 O95342 1/20 0.39
TP53 P04637 1/20 0.39
ADRB2 P07550 1/20 0.39
CHRM2 P08172 1/20 0.39
ADRB1 P08588 1/20 0.39
CYP3A4 P08684 1/20 0.39
ADRA2A P08913 1/20 0.39
ADORA3 P0DMS8 1/20 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
SCHEMBL10114726 0.87 NPC1 (0.37) NPC1RAB9AALDH1A1STAT3SMN1; SMN2
SCHEMBL4756608 0.85 ALDH1A1 (0.41) NPC1RAB9AALDH1A1STAT3SMN1; SMN2
SCHEMBL4757439 0.82 ALDH1A1 (0.42) NPC1RAB9AALDH1A1STAT3SMN1; SMN2
SCHEMBL4757435 0.77 ALDH1A1 (0.44) NPC1RAB9AALDH1A1STAT3SMN1; SMN2
SCHEMBL4757479 0.76 KCNMA1 (0.46) NPC1RAB9AALDH1A1STAT3SMN1; SMN2
SCHEMBL4757427 0.76 ALDH1A1 (0.47) NPC1RAB9AALDH1A1STAT3SMN1; SMN2
SCHEMBL4757381 0.75 STAT3 (0.60) NPC1RAB9AALDH1A1STAT3SMN1; SMN2
SCHEMBL4756770 0.74 RAB9A (0.45) NPC1RAB9AALDH1A1SMN1; SMN2MEN1
SCHEMBL4757379 0.73 STAT3 (0.56) NPC1RAB9AALDH1A1STAT3SMN1; SMN2
SCHEMBL10114130 0.73 FFAR2 (0.40) NPC1RAB9AALDH1A1STAT3SMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8895752-B2 Alkylsulfonyl-substituted thiazolide compounds ROMARK LABORATORIES L.C. (US) 2014-11-25 US disclosed
US-20120122939-A1 ALKYLSULFONYL-SUBSTITUTED THIAZOLIDE COMPOUNDS ROMARK LABORATORIES, L.C. 2012-05-17 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-20120122939-A1 ALKYLSULFONYL-SUBSTITUTED THIAZOLIDE COMPOUNDS HAVCR2, EIF2AK2, AADAC NPC1 585/4885RAB9A 1694/4885ALDH1A1 1605/4885

“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.