SCHEMBL1497003

SCHEMBL1497003

COc1ccc(CNC(=O)NC(CCN(C)C)c2ccc(C(=O)Nc3cscc3NC(=O)OC(C)(C)C)nc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 18/20 0.44
RAB9A P51151 1/20 0.37
ALDH1A1 P00352 1/20 0.37
CYP1A2 P05177 1/20 0.37
POLB P06746 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37
HPGD P15428 1/20 0.37
CYP2C19 P33261 1/20 0.37
ATM Q13315 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL1496849 0.93 UTS2R (0.44) UTS2R
SCHEMBL1497075 0.92 UTS2R (0.44) UTS2R
SCHEMBL1496907 0.91 UTS2R (0.45) UTS2RALDH1A1
SCHEMBL1497113 0.91 UTS2R (0.45) UTS2R
SCHEMBL1497059 0.88 UTS2R (0.47) UTS2RRAB9AALDH1A1CYP1A2POLB
SCHEMBL1496965 0.88 UTS2R (0.39) UTS2R
SCHEMBL1496976 0.87 UTS2R (0.45) UTS2RALDH1A1CYP3A4HPGD
SCHEMBL10476441 0.87 UTS2R (0.41) UTS2RALDH1A1POLBHPGD
SCHEMBL1497033 0.86 UTS2R (0.44) UTS2RALDH1A1POLB
SCHEMBL10476403 0.86 UTS2R (0.38) UTS2R

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-20120202808-A1 NOVEL THIOPHENEDIAMINE DERIVATIVE HAVING UREA STRUCTURE SANTEN PHARMACEUTICAL CO., LTD. (JP) 2012-08-09 US 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 UTS2R 195/4885RAB9A 2610/4885ALDH1A1 1240/4885

“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.