SCHEMBL6829154

SCHEMBL6829154

C=CC(=O)OC(C)C12CC3CC(CC(O)(C3)C1)C2

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 13/20 0.41
DPP8 Q6V1X1 2/20 0.35
DPP9 Q86TI2 2/20 0.35
FAP Q12884 1/20 0.35
PITRM1 Q5JRX3 1/20 0.35
DPP7 Q9UHL4 1/20 0.35
CYP3A4 P08684 1/20 0.34
PKM P14618 1/20 0.33
HSD11B1 P28845 1/20 0.33
NPC1 O15118 1/20 0.33
ALDH1A1 P00352 1/20 0.33

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
SCHEMBL28556200 0.91 ALDH1A1 (0.36) DPP4NPC1ALDH1A1
SCHEMBL4862776 0.86 ALDH1A1 (0.33) NPC1ALDH1A1
SCHEMBL7083721 0.85 ALDH1A1 (0.41) DPP4NPC1ALDH1A1
SCHEMBL4858009 0.84 ALDH1A1 (0.32) NPC1ALDH1A1
SCHEMBL5402455 0.83 DPP4 (0.42) DPP4DPP8DPP9FAPPITRM1
SCHEMBL15290896 0.78 MEN1 (0.38) CYP3A4ALDH1A1
SCHEMBL14632350 0.72 DPP4 (0.38) DPP4DPP8DPP9CYP3A4ALDH1A1
Acrylic Acid Methyl Ester SCHEMBL27973004 0.72 GLA (0.40) HSD11B1ALDH1A1
SCHEMBL28138310 0.71 NPSR1 (0.46) HSD11B1NPC1ALDH1A1
SCHEMBL6744403 0.71 HSD11B1 (0.32) DPP4PKMHSD11B1

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-1445266-A2 Photoresist copolymer Daicel Chemical Industries, Ltd. (JP) 2004-08-11 EP disclosed
US-20030180662-A1 Acid-sensitive compound and resin composition for photoresist DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2003-09-25 US disclosed
EP-1000924-A1 ACID-SENSITIVE COMPOUND AND RESIN COMPOSITION FOR PHOTORESIST Daichel Chemical Industries Ltd (JP) 2000-05-17 EP disclosed