SCHEMBL6935943

SCHEMBL6935943

CCOC(=O)CCc1cccn1-c1ccc(OCc2ccccc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 1/20 0.49
L3MBTL1 Q9Y468 4/20 0.48
LMNA P02545 1/20 0.48
FFAR4 Q5NUL3 2/20 0.47
ALDH1A1 P00352 1/20 0.46
FAAH O00519 1/20 0.46
MCHR1 Q99705 3/20 0.46
KCNH2 Q12809 2/20 0.46
PPARG P37231 1/20 0.46
PPARD Q03181 1/20 0.46
PPARA Q07869 1/20 0.46
FFAR1 O14842 1/20 0.45
EGFR P00533 2/20 0.45
LTA4H P09960 3/20 0.44
PTPN1 P18031 1/20 0.44
NPC1 O15118 1/20 0.44
PKM P14618 1/20 0.44
RAB9A P51151 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44

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
SCHEMBL6936992 0.83 FFAR4 (0.46) LMNAFFAR4ALDH1A1PTPN1
SCHEMBL3091164 0.81 FFAR1 (0.68) NR1H4L3MBTL1LMNAFFAR4ALDH1A1
SCHEMBL8561154 0.78 L3MBTL1 (0.50) NR1H4L3MBTL1LMNAALDH1A1FAAH
SCHEMBL8890454 0.77 FFAR1 (0.59) NR1H4L3MBTL1LMNAFFAR4ALDH1A1
SCHEMBL1115103 0.77 LTA4H (0.65) NR1H4L3MBTL1LMNAALDH1A1LTA4H
SCHEMBL2773462 0.77 FFAR1 (0.68) NR1H4L3MBTL1LMNAFFAR4ALDH1A1
SCHEMBL8888760 0.76 FFAR1 (0.58) NR1H4L3MBTL1LMNAFFAR4ALDH1A1
SCHEMBL8887581 0.76 FFAR1 (0.58) NR1H4L3MBTL1LMNAFFAR4ALDH1A1
SCHEMBL8890073 0.76 FFAR1 (0.58) NR1H4L3MBTL1LMNAFFAR4ALDH1A1
SCHEMBL19825762 0.76 FFAR1 (0.61) NR1H4L3MBTL1LMNAFFAR4ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0916651-B1 PHENYLALKYLCARBOXYLIC ACID DERIVATIVES SANKYO CO (JP) 2003-10-15 EP disclosed
US-6103907-A ALDOSE REDUCTASE INHIBITING ANTIDIABETIC AGENT SANKYO COMPANY, LIMITED (JP) 2000-08-15 US disclosed
CN-1219927-A Phenylalkylcarboxylic acid derivatives SANKYO CO (JP) 1999-06-16 CN disclosed
EP-0916651-A1 PHENYLALKYLCARBOXYLIC ACID DERIVATIVES Sankyo Company, Limited (JP) 1999-05-19 EP disclosed