SCHEMBL4636710

SCHEMBL4636710

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

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 2/20 0.33
CYP11B2 P19099 1/20 0.33
P2RX7 Q99572 6/20 0.32
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
THRB P10828 1/20 0.31
KMT2A Q03164 1/20 0.31
GPBAR1 Q8TDU6 1/20 0.31
CTSS P25774 2/20 0.31
ALDH2 P05091 1/20 0.31
DHODH Q02127 1/20 0.31
CTSK P43235 1/20 0.30

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
SCHEMBL4636754 0.90 ALDH1A1 (0.32) ALDH1A1LMNATHRBKMT2A
SCHEMBL4636792 0.90 CYP11B1 (0.35) CYP11B1CYP11B2P2RX7LMNAGPBAR1
SCHEMBL4163009 0.87 KMT2A (0.34) ALDH1A1LMNATHRBKMT2A
SCHEMBL4154057 0.86 TLR7 (0.40)
SCHEMBL4636352 0.86 P2RX7 (0.33) CYP11B1CYP11B2P2RX7GPBAR1CTSS
SCHEMBL5314184 0.86 P2RX7 (0.32) CYP11B1CYP11B2P2RX7ALDH2
SCHEMBL4637632 0.84 CES2 (0.33) ALDH1A1GPBAR1
SCHEMBL4668689 0.83 CYP11B1 (0.33) CYP11B1CYP11B2GPBAR1DHODH
SCHEMBL4637596 0.83 TAS1R3 (0.38) P2RX7CTSSDHODH
SCHEMBL4636197 0.82 ALDH2 (0.34) CYP11B1CYP11B2P2RX7ALDH1A1LMNA

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