SCHEMBL3434141

SCHEMBL3434141

Cc1cc(C(n2cccn2)(C(F)(F)F)C(F)(F)F)cc(C)c1NC(=O)O

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.33
POLB P06746 1/20 0.33
NLRP3 Q96P20 1/20 0.32
ELANE P08246 1/20 0.31
AR P10275 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
HPGD P15428 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
KCNN4 O15554 1/20 0.30
KCNA3 P22001 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
SCHEMBL1815565 0.86 LMNA (0.33) LMNAPOLBNLRP3ELANEAR
SCHEMBL3434620 0.83 LMNA (0.35) LMNAPOLBNLRP3ELANEL3MBTL1
SCHEMBL2261266 0.81 PTGS1 (0.46) SMN1; SMN2
SCHEMBL1816637 0.79
SCHEMBL2261331 0.78 KDM4E (0.48) LMNAPOLBL3MBTL1SMN1; SMN2
SCHEMBL2259159 0.77 POLB (0.35) POLBKCNN4KCNA3
SCHEMBL3431607 0.69 SMN1; SMN2 (0.46) ARHPGDSMN1; SMN2
SCHEMBL3420100 0.69 HSD11B1 (0.40) LMNAHPGD
SCHEMBL1818743 0.68 ADORA2A (0.35) KCNN4KCNA3
SCHEMBL3420846 0.66 NR1H2 (0.43) LMNAPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010015355-A2 NOVEL ACYLAMINOBENZAMIDE DERIVATIVES BAYER CROPSCIENCE AG (DE) 2010-02-11 WO disclosed