SCHEMBL9506717

SCHEMBL9506717

C=CC(=O)OCCCCc1cc(C(=O)c2ccccc2)ccc1C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.46
ELANE P08246 3/20 0.43
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 2/20 0.42
CYP3A4 P08684 1/20 0.42
TSHR P16473 1/20 0.42
POLB P06746 2/20 0.41
TDP1 Q9NUW8 3/20 0.39
LTB4R Q15722 1/20 0.39
PPARA Q07869 1/20 0.39
LSS P48449 2/20 0.38
THRA P10827 1/20 0.38
CDC25A P30304 1/20 0.38
CDC25B P30305 1/20 0.38
HSD17B10 Q99714 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.37
LMNA P02545 1/20 0.36
HPGD P15428 1/20 0.36
ATM Q13315 1/20 0.36
SRD5A2 P31213 1/20 0.36

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
SCHEMBL2478271 0.83 SRD5A2 (0.41) THRBELANEKDM4EALDH1A1CYP3A4
SCHEMBL28803965 0.83 THRB (0.43) THRBALDH1A1CYP3A4TSHRTDP1
SCHEMBL2320779 0.82 THRB (0.48) THRBKDM4EALDH1A1CYP3A4TSHR
SCHEMBL29832615 0.81 THRB (0.49) THRBALDH1A1CYP3A4TSHRTDP1
SCHEMBL7805497 0.81 ALDH1A1 (0.51) THRBALDH1A1CYP3A4TSHRTDP1
SCHEMBL11354707 0.81 KDM4E (0.48) ELANEKDM4EALDH1A1POLBTDP1
SCHEMBL9503942 0.79 TDP1 (0.65) THRBALDH1A1CYP3A4TSHRTDP1
SCHEMBL30996364 0.79 THRB (0.55) THRBALDH1A1CYP3A4TSHRTDP1
Benzophenone SCHEMBL28534387 0.79 TSHR (0.55) THRBALDH1A1CYP3A4TSHRTDP1
SCHEMBL22609158 0.78 THRB (0.66) THRBKDM4EALDH1A1CYP3A4TSHR

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 1 patent. 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