SCHEMBL13774591

SCHEMBL13774591

Cc1cc(S)ccc1N(C)C(=O)N(C)C(=O)c1c(F)cccc1F

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RORC P51449 8/20 0.41
TDP1 Q9NUW8 2/20 0.38
KDM4E B2RXH2 1/20 0.35
MAPT P10636 1/20 0.35
HTT P42858 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
POLB P06746 1/20 0.35
HSD17B1 P14061 4/20 0.33
HSD17B2 P37059 4/20 0.33
CES2 O00748 1/20 0.33
CES1 P23141 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
TSHR P16473 1/20 0.32
EPHX2 P34913 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
SCHEMBL13774593 0.90 RORC (0.39) RORCTDP1KDM4EMAPTHTT
SCHEMBL4158469 0.80 RORC (0.38) RORCTDP1KDM4EMAPTHTT
SCHEMBL4155292 0.80 RORC (0.38) RORCTDP1KDM4EMAPTHTT
SCHEMBL4149955 0.78 RORC (0.37) RORCTDP1KDM4EMAPTHTT
SCHEMBL4166873 0.76 RORC (0.36) RORCTDP1KDM4EMAPTHTT
SCHEMBL13774595 0.76 RORC (0.38) RORCTDP1POLBCES2CES1
SCHEMBL13774589 0.75 RORC (0.39) RORCTDP1POLBCES2CES1
SCHEMBL4913480 0.74 TLR7 (0.44) RORCTDP1TSHR
SCHEMBL4145216 0.74 RORC (0.38) RORCTDP1KDM4EPOLBCES2
SCHEMBL13774585 0.72 TDP1 (0.50) RORCTDP1KDM4EMEN1KMT2A

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090176786-A1 Benzoylurea Compounds and Use Thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-07-09 US 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-20090176786-A1 Benzoylurea Compounds and Use Thereof BTK, BRIX1, NFXL1 RORC 4448/4885TDP1 1690/4885KDM4E 1105/4885

“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.