SCHEMBL5456915

SCHEMBL5456915

CC(C)(C)OC(=O)Nc1ncc(F)cc1F

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.46
CYP17A1 P05093 1/20 0.39
RORC P51449 3/20 0.38
IRAK4 Q9NWZ3 3/20 0.38
AAK1 Q2M2I8 1/20 0.38
ATR Q13535 1/20 0.37
GSK3B P49841 1/20 0.36
DYRK1A Q13627 1/20 0.36
MAPKAPK2 P49137 1/20 0.36
ACVR1B P36896 1/20 0.36
TGFBR1 P36897 1/20 0.36
ACVRL1 P37023 1/20 0.36
EGLN2 Q96KS0 2/20 0.36
MAPK1 P28482 1/20 0.36
CDK5 Q00535 1/20 0.36
CDK5R1 Q15078 1/20 0.36
S1PR3 Q99500 1/20 0.36
NAMPT P43490 1/20 0.36

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
SCHEMBL7412985 0.87 SYK (0.42) SYKCYP17A1RORCAAK1ATR
SCHEMBL15599330 0.87 SYK (0.42) SYKCYP17A1RORCIRAK4ATR
SCHEMBL17282546 0.85 SYK (0.42) SYKCYP17A1RORCATRGSK3B
SCHEMBL29995121 0.85 SYK (0.42) SYKCYP17A1RORCATRGSK3B
SCHEMBL2960307 0.85 AAK1 (0.43) SYKCYP17A1RORCAAK1ATR
SCHEMBL25138307 0.83 ATR (0.42) SYKCYP17A1ATRACVR1BTGFBR1
SCHEMBL23167942 0.82 HDAC6 (0.56) SYK
SCHEMBL29995208 0.81 PRMT1 (0.40) SYKRORCMAPK1
SCHEMBL28973452 0.80 CTSS (0.43) SYKAAK1
SCHEMBL25552294 0.80 CTSS (0.43) SYKAAK1

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-20070249620-A1 Urea Derivative SANKYO COMPANY, LIMITED (JP) 2007-10-25 US disclosed
EP-1764360-A1 UREA DERIVATIVE Sankyo Company, Limited (JP) 2007-03-21 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-20070249620-A1 Urea Derivative UGP2, SLC14A1, DGAT1 SYK 4801/4885CYP17A1 2622/4885RORC 4400/4885

“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.