SCHEMBL8305542

SCHEMBL8305542

Cc1c(C(F)(F)F)[nH]c(=O)n(Cc2ccc(OC(C)C(=O)Cl)c(Cl)c2Cl)c1=O

nearest known ligand 0.32

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DDR1 Q08345 14/20 0.32
PPARG P37231 2/20 0.31
HSD17B13 Q7Z5P4 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HPGD P15428 1/20 0.30
TSHR P16473 1/20 0.30
HSD17B10 Q99714 1/20 0.30
CMA1 P23946 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
SCHEMBL8308409 0.91 ALDH1A1 (0.35) DDR1PPARGHSD17B13ALDH1A1MAPT
SCHEMBL8304561 0.90 P2RX3 (0.36) DDR1ALDH1A1MAPTSMN1; SMN2
SCHEMBL8309156 0.88 DDR1 (0.32) DDR1PPARGHSD17B13ALDH1A1MAPT
SCHEMBL8303099 0.84 HSD17B13 (0.33) DDR1HSD17B13ALDH1A1MAPTSMN1; SMN2
SCHEMBL8308815 0.83
SCHEMBL8303240 0.82 RORC (0.37) PPARGHSD17B13ALDH1A1MAPTHPGD
SCHEMBL8307160 0.79 KDM4E (0.37) DDR1ALDH1A1HPGDTSHRHSD17B10
SCHEMBL8305445 0.79 DDR1 (0.36) DDR1HPGDTSHRHSD17B10
SCHEMBL7468861 0.74 PPARG (0.35) PPARGHPGDCMA1
SCHEMBL7471937 0.72 BCAT1 (0.40) DDR1ALDH1A1MAPTSMN1; SMN2

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-0891336-A1 SUBSTITUTED 1-METHYL-3-BENZYLURACILS BASF AKTIENGESELLSCHAFT (DE) 1999-01-20 EP disclosed
WO-1997035845-A1 SUBSTITUTED 1-METHYL-3-BENZYLURACILS BASF AKTIENGESELLSCHAFT (DE) 1997-10-02 WO disclosed