SCHEMBL5141264

SCHEMBL5141264

Cc1cc(Cl)ccc1-c1ccccc1NC(=O)Oc1cn(C)nc1C(F)(F)F

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
POLB P06746 4/20 0.43
LMNA P02545 1/20 0.43
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
MAPT P10636 4/20 0.41
CHRM3 P20309 4/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
CYP1A2 P05177 2/20 0.38
CYP3A4 P08684 2/20 0.38
CYP2C19 P33261 2/20 0.38
CYP2C9 P11712 1/20 0.38
S1PR2 O95136 2/20 0.37
ALDH1A1 P00352 1/20 0.36
TP53 P04637 1/20 0.36
NPC1 O15118 1/20 0.36
PPARG P37231 1/20 0.36
JAK2 O60674 1/20 0.35

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
SCHEMBL3046034 0.92 CHRM3 (0.47) POLBLMNAMEN1KMT2AMAPT
SCHEMBL3038580 0.87 CHRM3 (0.42) POLBLMNAMEN1KMT2AMAPT
SCHEMBL3034453 0.86 CHRM3 (0.48) POLBLMNAMEN1KMT2AMAPT
SCHEMBL4775321 0.86 CHRM3 (0.46) POLBLMNAMEN1KMT2AMAPT
SCHEMBL5347251 0.86 CHRM3 (0.47) POLBLMNAMEN1KMT2AMAPT
SCHEMBL5140807 0.86 MEN1 (0.41) POLBLMNAMEN1KMT2AMAPT
SCHEMBL3036503 0.85 CHRM3 (0.38) POLBLMNAMEN1KMT2ACHRM3
SCHEMBL4455673 0.84 LMNA (0.60) POLBLMNAMEN1KMT2ASMN1; SMN2
SCHEMBL4563290 0.84 CHRM3 (0.40) POLBLMNACHRM3NPC1
SCHEMBL3024592 0.84 CHRM3 (0.44) POLBLMNACHRM3NPSR1NPC1

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-1898703-A1 FUNGICIDE MIXTURES BASED ON 2,4-DISUBSTITUTED PYRAZOLE CARBOXYLIC ACID BIPHENYLAMIDES BASF SE (DE) 2008-03-19 EP claimed
WO-2007000462-A1 FUNGICIDE MIXTURES BASED ON 2,4-DISUBSTITUTED PYRAZOLE CARBOXYLIC ACID BIPHENYLAMIDES BASF AKTIENGESELLSCHAFT (DE) 2007-01-04 WO claimed