SCHEMBL11174697

SCHEMBL11174697

COc1ccc(Oc2cc(Cl)cc(Cl)c2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 1/20 0.57
LTA4H P09960 2/20 0.54
CA12 O43570 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA7 P43166 1/20 0.50
CA9 Q16790 1/20 0.50
CA14 Q9ULX7 1/20 0.50
NPBWR1 P48145 1/20 0.47
MCHR1 Q99705 1/20 0.47
KMT2A Q03164 2/20 0.46
MEN1 O00255 1/20 0.46
ALDH1A1 P00352 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.44
PARP10 Q53GL7 1/20 0.44
HPGD P15428 1/20 0.44
RELA Q04206 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
ACHE P22303 1/20 0.42
FFAR4 Q5NUL3 1/20 0.42

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
SCHEMBL10875538 0.86 LTA4H (0.45) AHRLTA4HCA12CA1CA2
SCHEMBL987344 0.83 LTA4H (0.61) AHRLTA4HCA12CA1CA2
SCHEMBL16659209 0.82 SMN1; SMN2 (0.62) LTA4HKMT2AMEN1ALDH1A1HPGD
SCHEMBL12676795 0.82 TEAD4 (0.52) KMT2AMEN1ALDH1A1L3MBTL1SMN1; SMN2
SCHEMBL13119751 0.81 LTA4H (0.59) LTA4HKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL811578 0.80 ALDH1A1 (0.59) AHRCA12CA1CA2CA7
SCHEMBL10706723 0.80 TSHR (0.57) AHRKMT2AALDH1A1CARM1PRMT6
SCHEMBL83811 0.80 CA1 (0.79) LTA4HCA12CA1CA2CA7
SCHEMBL166536 0.80 CA1 (0.79) LTA4HCA12CA1CA2CA7
SCHEMBL11580995 0.80 CA1 (0.79) LTA4HCA12CA1CA2CA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4391995-A 4-Phenoxy-phenoxy-alkane-carboxylic acid derivatives and process for their manufacture HOECHST AKTIENGESELLSCHAFT (DE) 1983-07-05 US disclosed
US-4301295-A ANTILIPEMIC AND ANTICHOLESTEROL AGENTS HOECHST AKTIENGESELLSCHAFT (DE) 1981-11-17 US disclosed
US-4238626-A ANTICHOLESTEROL AND ANTILIPEMIC AGENTS HOECHST AKTIENGESELLSCHAFT (DE) 1980-12-09 US disclosed