SCHEMBL8874173

SCHEMBL8874173

CCSc1nc(N)nc(Cl)c1OC(F)F

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.37
HSP90AA1 P07900 1/20 0.33
HPGD P15428 3/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
PLA2G1B P04054 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
ATG4B Q9Y4P1 1/20 0.32
TSHR P16473 1/20 0.32
HTT P42858 1/20 0.32
ALDH1A1 P00352 2/20 0.31
GAA P10253 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL8874425 0.83 NUDT1 (0.33) KDM4EALDH1A1
SCHEMBL7934006 0.78 DPP4 (0.31) HSP90AA1
SCHEMBL8874251 0.74 KDM4E (0.39) KDM4EHSP90AA1HPGDSMN1; SMN2
SCHEMBL11367289 0.73 HSP90AA1 (0.41) KDM4EHSP90AA1HPGDMEN1KMT2A
SCHEMBL8873259 0.73 PGK1 (0.34) KDM4EHPGDALDH1A1GAASMN1; SMN2
SCHEMBL7932055 0.71 CCNA2 (0.39)
SCHEMBL8874150 0.70 LRRK2 (0.34)
SCHEMBL8874055 0.70 RAB9A (0.31) HSP90AA1CYP1A2CYP3A4TSHR
SCHEMBL7932063 0.68 KDM4E (0.31) KDM4E
SCHEMBL8873470 0.65 CDK1 (0.42)

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-5591694-A COMPOUND USED TO CONTROL UNDESIRABLE PLANT GROWTH BASF AKTIENGESELLSCHAFT (DE) 1997-01-07 US disclosed
US-5276007-A Herbicidal sulfonylureas BASF AKTIENGESELLSCHAFT (DE) 1994-01-04 US disclosed