SCHEMBL1496848

SCHEMBL1496848

Cc1cccc(NC(=O)NC(CCCN(C)C)c2ccc(C(=O)Nc3cscc3NC(=O)OC(C)(C)C)nc2)c1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 10/20 0.42
MAPT P10636 5/20 0.40
KDM4E B2RXH2 3/20 0.40
TDP1 Q9NUW8 3/20 0.40
NPSR1 Q6W5P4 3/20 0.40
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
KMT2A Q03164 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
AURKA O14965 1/20 0.37
ALK Q9UM73 1/20 0.37
MAPK1 P28482 1/20 0.37
NTSR1 P30989 1/20 0.36
ATM Q13315 1/20 0.35
ROCK2 O75116 1/20 0.35
ROCK1 Q13464 1/20 0.35

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
SCHEMBL10476392 0.95 UTS2R (0.47) UTS2RMAPTKDM4ETDP1NPSR1
SCHEMBL3234013 0.94 UTS2R (0.43) UTS2RMAPTKDM4ETDP1NPSR1
SCHEMBL1496869 0.93 UTS2R (0.41) UTS2RSMN1; SMN2ATMROCK2ROCK1
SCHEMBL3224956 0.89 UTS2R (0.48) UTS2RMAPTKDM4ETDP1NPSR1
SCHEMBL1496836 0.89 UTS2R (0.39) UTS2RROCK2ROCK1
SCHEMBL1496837 0.88 UTS2R (0.46) UTS2RAURKAATMROCK2ROCK1
SCHEMBL1497089 0.88 UTS2R (0.42) UTS2RMAPTMEN1ALDH1A1LMNA
SCHEMBL11899970 0.87 UTS2R (0.59) UTS2RALDH1A1SMN1; SMN2ROCK2ROCK1
SCHEMBL3226027 0.87 UTS2R (0.42) UTS2RMAPTMEN1KMT2AATM
SCHEMBL3218967 0.87 UTS2R (0.42) UTS2RMAPTALDH1A1ATMROCK2

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 UTS2R 195/4885MAPT 4667/4885KDM4E 2885/4885

“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.