SCHEMBL4835285

SCHEMBL4835285

Cn1cc(OC(=O)Nc2ccccc2-c2cc(F)ccc2Cl)c(C(F)(F)F)n1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.39
NR3C1 P04150 1/20 0.39
PGR P06401 1/20 0.39
POLB P06746 1/20 0.38
CHRM3 P20309 7/20 0.38
CHRM2 P08172 1/20 0.38
CHRM1 P11229 1/20 0.38
RAB9A P51151 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
P2RX7 Q99572 1/20 0.36
HSD11B1 P28845 1/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
GAA P10253 1/20 0.36
PDE2A O00408 1/20 0.35
PDE10A Q9Y233 1/20 0.35
NPC1 O15118 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
SCHEMBL3041242 0.90 CHRM3 (0.40) LMNANR3C1PGRPOLBCHRM3
SCHEMBL3038580 0.90 CHRM3 (0.42) LMNAPOLBCHRM3MEN1KMT2A
SCHEMBL3043533 0.89 CHRM3 (0.48) LMNANR3C1PGRCHRM3RAB9A
SCHEMBL4848046 0.87 CHRM3 (0.48) LMNANR3C1PGRCHRM3CHRM2
SCHEMBL1039642 0.86 CHRM3 (0.51) LMNANR3C1PGRCHRM3CHRM2
SCHEMBL3036503 0.86 CHRM3 (0.38) LMNAPOLBCHRM3MEN1KMT2A
SCHEMBL3046034 0.86 CHRM3 (0.47) LMNAPOLBCHRM3NPSR1MEN1
SCHEMBL3150885 0.86 CHRM3 (0.48) LMNAPOLBCHRM3NPSR1MEN1
SCHEMBL1077648 0.85 CHRM3 (0.50) LMNACHRM3CHRM2CHRM1NPSR1
SCHEMBL3024592 0.85 CHRM3 (0.44) LMNAPOLBCHRM3RAB9ANPSR1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1898704-A1 FUNGICIDAL MIXTURES BASED ON 2,5-DISUBSTITUTED PYRAZOL CARBOXYLIC ACID BIPHENYLAMIDES BASF SE (DE) 2008-03-19 EP claimed
WO-2007003540-A1 FUNGICIDAL MIXTURES BASED ON 2,5-DISUBSTITUTED PYRAZOL CARBOXYLIC ACID BIPHENYLAMIDES BASF AKTIENGESELLSCHAFT (DE) 2007-01-11 WO claimed
EP-1898704-A1 FUNGICIDAL MIXTURES BASED ON 2,5-DISUBSTITUTED PYRAZOL CARBOXYLIC ACID BIPHENYLAMIDES BASF SE (DE) 2008-03-19 EP disclosed
WO-2007003540-A1 FUNGICIDAL MIXTURES BASED ON 2,5-DISUBSTITUTED PYRAZOL CARBOXYLIC ACID BIPHENYLAMIDES BASF AKTIENGESELLSCHAFT (DE) 2007-01-11 WO disclosed