SCHEMBL11115889

SCHEMBL11115889

COC(=O)CCCCCCCNc1cccc(Cl)c1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 5/20 0.54
LMNA P02545 2/20 0.51
MAPT P10636 4/20 0.50
ALDH1A1 P00352 3/20 0.50
EPHX1 P07099 3/20 0.49
KDM4E B2RXH2 1/20 0.48
GAA P10253 1/20 0.48
HSD17B10 Q99714 1/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
L3MBTL1 Q9Y468 1/20 0.46
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
HTT P42858 1/20 0.45

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
SCHEMBL22350388 0.84 LMNA (0.50) LMNAMAPTALDH1A1KDM4EGAA
SCHEMBL11954527 0.83 EPHX2 (0.58) EPHX2MAPTALDH1A1EPHX1GAA
SCHEMBL1472555 0.83 LMNA (0.66) LMNAMAPTALDH1A1KDM4EGAA
SCHEMBL11121506 0.82 HDAC3 (0.54) LMNAMAPTALDH1A1KDM4EGAA
SCHEMBL24258886 0.81 LMNA (0.47) LMNAMAPTALDH1A1KDM4EGAA
SCHEMBL7593370 0.80 MEN1 (0.51) LMNAMAPTALDH1A1GAAMEN1
SCHEMBL8409099 0.80 KDM4E (0.49) LMNAMAPTALDH1A1KDM4EGAA
SCHEMBL499872 0.80 RAB9A (0.54) EPHX2LMNAMAPTALDH1A1EPHX1
SCHEMBL1532303 0.79 MAPT (0.50) EPHX2LMNAMAPTALDH1A1EPHX1
Hydrochloric Acid SCHEMBL15646288 0.79 MEN1 (0.50) LMNAMAPTALDH1A1GAAMEN1

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
EP-0051828-B1 N-BENZOYL-ALPHA-ANILINO ALKANE CARBOXYLIC ACIDS, SALTS AND ESTERS THEREOF, PROCESS FOR PRODUCING THE SAME AND PHARMACEUTICAL PREPARATIONS CONTAINING THE SAME A. Nattermann & Cie. GmbH (DE) 1984-03-14 EP disclosed
US-4386031-A ANTICOAGULANTS; ANTIALLERGENS; ANTINFLAM-MATORY AND ANTILIPEMIC AGENTS; ANTIHISTAMINES; CARDIOVASCULAR DISORDERS A. NATTERMANN & CIE GMBH (DE) 1983-05-31 US disclosed
EP-0051828-A1 N-benzoyl-alpha-anilino alkane carboxylic acids, salts and esters thereof, process for producing the same and pharmaceutical preparations containing the same A. Nattermann & Cie. GmbH (DE) 1982-05-19 EP disclosed