SCHEMBL7278067

SCHEMBL7278067

CCCCC=CCC=C(C)C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 5/20 0.44
ALDH1A1 P00352 5/20 0.44
F7 P08709 5/20 0.44
F3 P13726 5/20 0.44
PPARD Q03181 4/20 0.44
PPARA Q07869 4/20 0.44
KDM4E B2RXH2 4/20 0.44
FFAR1 O14842 3/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
LMNA P02545 2/20 0.44
CYP3A4 P08684 2/20 0.44
CYP19A1 P11511 2/20 0.44
FABP4 P15090 2/20 0.44
HPGD P15428 2/20 0.44
ALOX15 P16050 2/20 0.44
NR4A2 P43354 2/20 0.44
HSD17B10 Q99714 2/20 0.44
TDP1 Q9NUW8 2/20 0.44
PTGS1 P23219 2/20 0.44
AKR1C3 P42330 2/20 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
SCHEMBL15269474 0.91 ALDH1A1 (0.53) PPARGALDH1A1F7F3PPARD
SCHEMBL28959749 0.91 ALDH1A1 (0.53) PPARGALDH1A1F7F3PPARD
SCHEMBL1977301 0.85 PPARG (0.33) PPARGALDH1A1F7F3PPARD
SCHEMBL19256983 0.83 F7 (0.43) PPARGF7F3PPARDPPARA
SCHEMBL6975650 0.83 F7 (0.43) PPARGF7F3PPARDPPARA
SCHEMBL29068792 0.79 PPARG (0.47) PPARGALDH1A1F7F3PPARD
SCHEMBL7192121 0.78 CYP19A1 (0.36) PPARGALDH1A1F7F3CYP3A4
SCHEMBL9655533 0.77 TSHR (0.37) PPARGALDH1A1F7F3PPARD
SCHEMBL9655529 0.77 TSHR (0.37) PPARGALDH1A1F7F3PPARD
SCHEMBL957232 0.76

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0696585-B1 NOVEL BISOXADIAZOLIDINE DERIVATIVE YAMANOUCHI PHARMA CO LTD (JP) 1998-12-16 EP disclosed
US-5643931-A ANTIDIABETIC AGENTS YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1997-07-01 US disclosed
EP-0696585-A1 NOVEL BISOXADIAZOLIDINE DERIVATIVE YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1996-02-14 EP disclosed
US-5039674-A Calcium antagonistics YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1991-08-13 US disclosed
US-4782160-A CALCIUM RECEPTOR ANTAGONISTS YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1988-11-01 US disclosed
EP-0276552-A1 1,4-dihydropyridine derivatives and their production YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1988-08-03 EP disclosed