SCHEMBL4637596

SCHEMBL4637596

CN(C(=O)NC(=O)c1cccc(Cl)c1Cl)c1ccc(SC(F)(F)F)cc1F

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 1/20 0.38
TAS1R1 Q7RTX1 1/20 0.38
TAS1R2 Q8TE23 1/20 0.38
TMEM97 Q5BJF2 2/20 0.35
SIGMAR1 Q99720 2/20 0.35
GPR35 Q9HC97 1/20 0.35
P2RX7 Q99572 2/20 0.34
PCTP Q9UKL6 1/20 0.34
STARD10 Q9Y365 1/20 0.34
RXFP1 Q9HBX9 3/20 0.34
F2R P25116 1/20 0.34
KCNK2 O95069 3/20 0.33
KCNK10 P57789 3/20 0.33
JAK2 O60674 1/20 0.33
DHODH Q02127 1/20 0.33
RORC P51449 1/20 0.33
CTSS P25774 1/20 0.32

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
SCHEMBL4636792 0.93 CYP11B1 (0.35) P2RX7RXFP1KCNK2KCNK10DHODH
SCHEMBL4149982 0.89 RORC (0.38) RORC
SCHEMBL4154004 0.87 TLR7 (0.42) RORC
SCHEMBL4637507 0.86 RXFP1 (0.35) RXFP1KCNK2KCNK10CTSS
SCHEMBL5425678 0.85 P2RX7 (0.38) TAS1R3TAS1R1TAS1R2TMEM97SIGMAR1
SCHEMBL4636352 0.83 P2RX7 (0.33) P2RX7DHODHCTSS
SCHEMBL4636710 0.83 CYP11B1 (0.33) P2RX7DHODHCTSS
SCHEMBL4158996 0.83 TRPA1 (0.34) RXFP1KCNK2KCNK10RORC
SCHEMBL4150976 0.81 MEN1 (0.39) RORC
SCHEMBL4637632 0.78 CES2 (0.33)

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
EP-1937629-A2 BENZOYLUREA COMPOUNDS AND USE THEREOF Sumitomo Chemical Company, Limited (JP) 2008-07-02 EP disclosed
WO-2007046513-A2 BENZOYLUREA COMPOUNDS AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-04-26 WO disclosed