SCHEMBL4757366

SCHEMBL4757366

Cc1ccc(C(=O)Nc2nc(S(C)(=O)=O)cs2)cc1I

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 6/20 0.53
RAB9A P51151 6/20 0.53
MEN1 O00255 3/20 0.53
KMT2A Q03164 3/20 0.53
ALDH1A1 P00352 2/20 0.53
GAA P10253 1/20 0.53
MAPT P10636 2/20 0.49
LMNA P02545 2/20 0.48
HPGD P15428 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
NFKB1 P19838 2/20 0.48
NFKB2 Q00653 2/20 0.48
RELA Q04206 2/20 0.48
USP2 O75604 1/20 0.47
POLB P06746 2/20 0.46
GCK P35557 5/20 0.46
RXFP1 Q9HBX9 1/20 0.46
KDM4A O75164 1/20 0.44
KDM4B O94953 1/20 0.44
KDM5C P41229 1/20 0.44

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
SCHEMBL10114651 0.83 ALDH1A1 (0.46) NPC1RAB9AMEN1KMT2AALDH1A1
SCHEMBL4757285 0.82 RAB9A (0.64) NPC1RAB9AMEN1KMT2AALDH1A1
SCHEMBL4757279 0.81 RRM1 (0.62) NPC1RAB9AMEN1KMT2AALDH1A1
SCHEMBL4757037 0.81 GCK (0.58) NPC1RAB9AMEN1KMT2AALDH1A1
SCHEMBL703145 0.80 RAB9A (0.60) NPC1RAB9AMEN1KMT2AALDH1A1
SCHEMBL4757096 0.80 NPC1 (0.48) NPC1RAB9AMEN1KMT2AALDH1A1
SCHEMBL4757970 0.78 NPC1 (0.65) NPC1RAB9AMEN1KMT2AALDH1A1
SCHEMBL4757291 0.78 NPC1 (0.49) NPC1RAB9AMEN1KMT2AALDH1A1
SCHEMBL704070 0.78 KDM4A (0.54) NPC1RAB9AMEN1KMT2AALDH1A1
SCHEMBL4757029 0.77 RAB9A (0.50) NPC1RAB9AMEN1KMT2AALDH1A1

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 1694/4885MEN1 4564/4885

“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.