SCHEMBL11324734

SCHEMBL11324734

CC(c1ccccc1)N(CCCCCC(=O)N(CCCC(=O)O)Cc1ccccc1)C(=O)c1ccc(Cl)cc1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PDE6D O43924 2/20 0.45
▸ FOLH1 Q04609 4/20 0.45
▸ TMEM97 Q5BJF2 3/20 0.41
▸ SIGMAR1 Q99720 3/20 0.41
▸ KDM4A O75164 2/20 0.41
▸ KDM4C Q9H3R0 2/20 0.41
▸ BCHE P06276 1/20 0.40
▸ ACHE P22303 1/20 0.40
▸ GLP1R P43220 1/20 0.40
▸ GCGR P47871 1/20 0.40
▸ KRAS P01116 1/20 0.39
▸ MC4R P32245 3/20 0.39
▸ MC5R P33032 3/20 0.39
▸ MC3R P41968 3/20 0.39
▸ HDAC1 Q13547 2/20 0.39
▸ CNR2 P34972 1/20 0.39

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
SCHEMBL11318737 0.97 TMEM97 (0.42) PDE6DFOLH1TMEM97SIGMAR1GLP1R
SCHEMBL11328953 0.89 HDAC6 (0.44) HDAC1
SCHEMBL11327056 0.87 POLB (0.43) —
SCHEMBL11314879 0.83 OPRD1 (0.43) PDE6DFOLH1TMEM97SIGMAR1KDM4A
SCHEMBL11320955 0.81 OPRD1 (0.44) FOLH1TMEM97SIGMAR1GLP1RGCGR
SCHEMBL11326306 0.79 CCKBR (0.41) PDE6DBCHEACHE
SCHEMBL11224728 0.79 TMEM97 (0.49) TMEM97SIGMAR1HDAC1
SCHEMBL11224743 0.78 POLB (0.40) PDE6DFOLH1GCGRHDAC1
SCHEMBL11320468 0.77 AGER (0.50) TMEM97SIGMAR1HDAC1
SCHEMBL11322274 0.77 ALOX5 (0.44) —

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
US-4250183-A GASTOINTESTINAL DISORDERS; DISEASES OF THE PANCREAS, GALL BLADDER, AND LIVER BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1981-02-10 — — US disclosed
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