SCHEMBL7053967

SCHEMBL7053967

O=C(Cl)Oc1cc(F)ccc1-c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FABP7 O15540 1/20 0.42
FABP3 P05413 1/20 0.42
FABP5 Q01469 1/20 0.42
CYP11B1 P15538 2/20 0.42
CYP11B2 P19099 2/20 0.42
BACE1 P56817 1/20 0.41
FFAR4 Q5NUL3 4/20 0.40
MAPT P10636 2/20 0.40
FFAR1 O14842 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
CHRM2 P08172 1/20 0.39
CHRM1 P11229 1/20 0.39
CHRM3 P20309 1/20 0.39
ALDH1A1 P00352 2/20 0.39
LMNA P02545 1/20 0.39
KDM4E B2RXH2 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
KCNH2 Q12809 1/20 0.39
CTSA P10619 1/20 0.38

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
SCHEMBL20573246 0.84 FABP7 (0.42) FABP7FABP3FABP5CYP11B1CYP11B2
SCHEMBL6220741 0.83 FABP3 (0.53) FABP7FABP3FABP5TDP1L3MBTL1
SCHEMBL29922550 0.83 FABP3 (0.53) FABP7FABP3FABP5TDP1L3MBTL1
SCHEMBL7049514 0.81 PTGDR2 (0.50) BACE1TDP1L3MBTL1ALDH1A1LMNA
SCHEMBL7052744 0.80 BACE1 (0.58) FABP5CYP11B1CYP11B2BACE1FFAR4
SCHEMBL10442091 0.78 FFAR4 (0.45) CYP11B1CYP11B2BACE1FFAR4ALDH1A1
SCHEMBL6609680 0.74 KCNH2 (0.53) CYP11B1CYP11B2KCNH2CTSA
SCHEMBL20573259 0.73 PARP1 (0.42)
SCHEMBL5696260 0.72 SERPINE1 (0.43) MAPTTDP1ALDH1A1LMNAKDM4E
SCHEMBL30524282 0.72 SERPINE1 (0.43) MAPTTDP1ALDH1A1LMNAKDM4E

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-1301464-A1 BIPHENYLCARBOXYLIC ACID AMIDES, PRODUCTION THEREOF AND USE THEREOF AS MEDICAMENTS Boehringer Ingelheim Pharma KG (DE) 2003-04-16 EP disclosed
WO-2002004403-A1 BIPHENYLCARBOXYLIC ACID AMIDES, PRODUCTION THEREOF AND USE THEREOF AS MEDICAMENTS BOEHRINGER INGELHEIM PHARMA KG (DE) 2002-01-17 WO disclosed