SCHEMBL16732009

SCHEMBL16732009

CCCC(C(=O)O)(C(=O)O)C1CCCC1

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.36
NFE2L2 Q16236 1/20 0.36
CCR2 P41597 1/20 0.33
EPHX1 P07099 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
CYP1A2 P05177 1/20 0.32
CHRM2 P08172 1/20 0.32
CYP2D6 P10635 1/20 0.32
CHRM1 P11229 1/20 0.32
KCNH2 Q12809 1/20 0.32
SSTR4 P31391 1/20 0.32
NAAA Q02083 3/20 0.32
HSD17B10 Q99714 2/20 0.31
LMNA P02545 1/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CA4 P22748 1/20 0.30

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
SCHEMBL8330842 0.98 CYP1A2 (0.35) KEAP1NFE2L2CCR2EPHX1KDM4E
SCHEMBL4581023 0.91 LMNA (0.33) ALDH1A1CYP1A2HSD17B10LMNA
SCHEMBL4580955 0.91 LMNA (0.33) ALDH1A1CYP1A2HSD17B10LMNA
SCHEMBL4969315 0.83 ARG1 (0.41) CCR2EPHX1CYP2D6LMNA
SCHEMBL11023958 0.82 ALDH1A1 (0.36) KDM4EALDH1A1CYP1A2CHRM2CYP2D6
SCHEMBL8734148 0.82 KEAP1 (0.38) KEAP1NFE2L2EPHX1KDM4EALDH1A1
SCHEMBL16783911 0.82 EPHX2 (0.35) CCR2EPHX1KDM4EALDH1A1SSTR4
SCHEMBL16732329 0.80 EPHX2 (0.38) CCR2EPHX1KDM4EALDH1A1CHRM2
SCHEMBL8735978 0.80 KEAP1 (0.37) KEAP1NFE2L2EPHX1KDM4EALDH1A1
SCHEMBL21269269 0.78 KEAP1 (0.36) KEAP1NFE2L2EPHX1KDM4EALDH1A1

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-2876118-A1 METHOD FOR PRODUCING SOLID CATALYST COMPONENT FOR USE IN POLYMERIZATION OF OLEFIN, CATALYST FOR USE IN POLYMERIZATION OF OLEFIN, AND METHOD FOR PRODUCING OLEFIN POLYMER Toho Titanium CO., LTD. (JP) 2015-05-27 EP disclosed