SCHEMBL1497013

SCHEMBL1497013

CN1CCN(CCC(NC(=O)Nc2ccsc2)c2ccc(C(=O)Nc3cscc3NC(=O)OC(C)(C)C)nc2)CC1

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CSF1R P07333 1/20 0.36
FLT3 P36888 1/20 0.36
ABL1 P00519 1/20 0.34
SRC P12931 1/20 0.34
CCR5 P51681 2/20 0.33
MAPK1 P28482 1/20 0.33
MAPK14 Q16539 1/20 0.33
WDR5 P61964 1/20 0.32
FGFR1 P11362 1/20 0.32
ELANE P08246 1/20 0.32
AKT1 P31749 1/20 0.32
CCR2 P41597 2/20 0.32
CD274 Q9NZQ7 1/20 0.31
TRPA1 O75762 1/20 0.31
CNR1 P21554 1/20 0.31
HDAC3 O15379 1/20 0.31
PTPRB P23467 1/20 0.31
HRH2 P25021 1/20 0.31
HRH1 P35367 1/20 0.31

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
SCHEMBL1496991 0.95 CSF1R (0.35) CSF1RFLT3ABL1SRCMAPK14
SCHEMBL1497117 0.95 UTS2R (0.35) CCR5MAPK1ELANECCR2
SCHEMBL1496855 0.93 CD274 (0.40) CD274
SCHEMBL1497057 0.91 ACHE (0.38) MAPK1ELANEHRH2HRH1
SCHEMBL1496958 0.89 CD274 (0.39) CD274
SCHEMBL1496936 0.86 CYP1A2 (0.38) CSF1RFLT3CCR5MAPK1MAPK14
SCHEMBL10476436 0.86 UTS2R (0.44)
SCHEMBL3234196 0.85 CSF1R (0.39) CSF1RFLT3ABL1SRCFGFR1
SCHEMBL1496924 0.85 SIGMAR1 (0.39) CCR5FGFR1CCR2HRH2HRH1
SCHEMBL3230179 0.85 JAK2 (0.38) CD274

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 CSF1R 2464/4885FLT3 1337/4885ABL1 670/4885

“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.