SCHEMBL9507554

SCHEMBL9507554

C=CC(=O)OC(CC)Cc1cccc(C(=O)O)c1C(=O)c1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 2/20 0.36
ABCB1 P08183 2/20 0.36
PRKCG P05129 1/20 0.35
PRKCB P05771 1/20 0.35
PRKCA P17252 1/20 0.35
PRKCH P24723 1/20 0.35
PRKCE Q02156 1/20 0.35
PRKCD Q05655 1/20 0.35
RAB9A P51151 2/20 0.34
LMNA P02545 2/20 0.34
CLCN2 P51788 1/20 0.34
ALDH1A1 P00352 1/20 0.34
MAPK1 P28482 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
THRA P10827 1/20 0.34
THRB P10828 1/20 0.34
POLB P06746 1/20 0.33
PPARG P37231 2/20 0.33
PPARA Q07869 1/20 0.33
MYC P01106 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
SCHEMBL6567060 0.91 CLCN2 (0.35) PRKCGPRKCBPRKCAPRKCHPRKCE
SCHEMBL3774107 0.78 PRKCG (0.34) PRKCGPRKCBPRKCAPRKCHPRKCE
SCHEMBL690261 0.76 PRKCG (0.36) PRKCGPRKCBPRKCAPRKCHPRKCE
SCHEMBL4663492 0.75 FOLH1 (0.37) CLCN2ALDH1A1THRATHRBPPARG
SCHEMBL9503922 0.74 ALDH1A1 (0.44) AKR1C3ABCB1LMNAALDH1A1L3MBTL1
SCHEMBL1898144 0.74 PPARG (0.36) CLCN2ALDH1A1THRATHRBPPARG
SCHEMBL3953768 0.74 AKR1C3 (0.55) AKR1C3CLCN2ALDH1A1L3MBTL1POLB
SCHEMBL610158 0.74 SLC37A4 (0.35) PRKCGPRKCBPRKCAPRKCHPRKCE
SCHEMBL23121518 0.73 SLC37A4 (0.43) RAB9ALMNACLCN2ALDH1A1THRB
SCHEMBL15512712 0.73 ABCB1 (0.48) ABCB1RAB9ALMNAL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0367054-B1 UV CROSSLINKABLE COMPOSITION BASED ON COPOLYMERS OF ISOAMYL (METH)ACRYLATES BASF Aktiengesellschaft (DE) 1993-06-23 EP claimed
EP-0367054-B1 UV CROSSLINKABLE COMPOSITION BASED ON COPOLYMERS OF ISOAMYL (METH)ACRYLATES BASF Aktiengesellschaft (DE) 1993-06-23 EP disclosed