SCHEMBL8848014

SCHEMBL8848014

CCCCc1nc2c(C)ccc(OCCCCn3cnc4ccccc43)c2n1Cc1ccc(-c2ccccc2C(=O)OC(C)(C)C)cc1

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 2/20 0.47
AGTR2 P50052 2/20 0.47
PPARG P37231 7/20 0.45
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
MAPT P10636 1/20 0.43
HTT P42858 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL8847658 0.99 AGTR1 (0.47) AGTR1AGTR2PPARGKDM4EALDH1A1
SCHEMBL8848293 0.98 AGTR1 (0.48) AGTR1AGTR2PPARG
SCHEMBL8848196 0.97 AGTR1 (0.48) AGTR1AGTR2PPARG
SCHEMBL7309046 0.91 AGTR1 (0.58) AGTR1AGTR2PPARG
SCHEMBL7302801 0.91 LMNA (0.43) AGTR1AGTR2PPARGKDM4EALDH1A1
SCHEMBL7310637 0.91 AGTR1 (0.57) AGTR1AGTR2PPARG
SCHEMBL7306067 0.90 LMNA (0.42) AGTR1AGTR2PPARGKDM4EALDH1A1
SCHEMBL8847656 0.89 AGTR1 (0.47) AGTR1AGTR2PPARGKDM4EALDH1A1
SCHEMBL8394561 0.89 ACHE (0.49) AGTR1AGTR2PPARG
SCHEMBL7309295 0.89 AGTR1 (0.42) AGTR1AGTR2PPARGKDM4EALDH1A1

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
US-5614519-A (1-(2,3 or 4-N-morpholinoalkyl)-imidazol-4-yl)-benizimidazol-1-yl-methyl]-biphenyls useful as angiotensin-II antagonists KARL THOMAE GMBH (DE) 1997-03-25 US disclosed
US-5602127-A ADMINISTERING TO TREAT HYPERTENSION KARL THOMAE GMBH (DE) 1997-02-11 US disclosed
US-5594003-A HYPOTENSIVE AGENTS DR. KARL THOMAE GMBH (DE) 1997-01-14 US disclosed
US-5591762-A HYPOTENSIVE AGENTS DR. KARL THOMAE GMBH (DE) 1997-01-07 US disclosed