SCHEMBL1496899

SCHEMBL1496899

CN(C)CCCC(NC(=O)NCCc1ccccc1)c1ccc(C(=O)Nc2cscc2NC(=O)OC(C)(C)C)nc1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CTSK P43235 4/20 0.40
UTS2R Q9UKP6 7/20 0.39
HIF1A Q16665 1/20 0.35
MAPT P10636 1/20 0.35
EPHX2 P34913 2/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
SCD O00767 1/20 0.35
RAF1 P04049 1/20 0.34
CTSS P25774 1/20 0.34

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
SCHEMBL1496866 0.95 UTS2R (0.44) CTSKUTS2RHIF1A
SCHEMBL2383826 0.95 CTSK (0.41) CTSKUTS2RHIF1AMAPTEPHX2
SCHEMBL11898930 0.93 UTS2R (0.43) CTSKUTS2REPHX2
SCHEMBL10476396 0.91 UTS2R (0.42) CTSKUTS2RHIF1A
SCHEMBL3233800 0.90 UTS2R (0.46) CTSKUTS2RHIF1A
SCHEMBL10476443 0.88 UTS2R (0.38) UTS2RRAF1
SCHEMBL1496865 0.88 UTS2R (0.36) UTS2RRAF1
SCHEMBL1496849 0.88 UTS2R (0.44) UTS2RMEN1KMT2A
SCHEMBL1497005 0.87 UTS2R (0.42) UTS2RHIF1AEPHX2MEN1KMT2A
SCHEMBL1496947 0.87 SIGMAR1 (0.41) CTSKKMT2ASCD

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-20120202808-A1 NOVEL THIOPHENEDIAMINE DERIVATIVE HAVING UREA STRUCTURE SANTEN PHARMACEUTICAL CO., LTD. (JP) 2012-08-09 US disclosed
EP-2292611-B1 NOVEL THIOPHENEDIAMINE DERIVATIVE HAVING UREA STRUCTURE SANTEN PHARMACEUTICAL CO LTD (JP) 2012-07-25 EP disclosed
EP-2292611-A1 NOVEL THIOPHENEDIAMINE DERIVATIVE HAVING UREA STRUCTURE Santen Pharmaceutical Co., Ltd (JP) 2011-03-09 EP 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-20120202808-A1 NOVEL THIOPHENEDIAMINE DERIVATIVE HAVING UREA STRUCTURE CBR1, NAT1, PRMT1 CTSK 4401/4885UTS2R 195/4885HIF1A 1202/4885

“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.