SCHEMBL7971973

SCHEMBL7971973

Cc1cc(-c2ccc(C3(c4ccc(Cl)cc4)OC(=O)C(O)=C3O)cc2)c2ccccc2c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 2/20 0.39
CA12 O43570 2/20 0.37
CA9 Q16790 2/20 0.37
DHFR P00374 5/20 0.36
TYMS P04818 2/20 0.36
ALDH1A1 P00352 2/20 0.35
MEN1 O00255 2/20 0.35
MAPT P10636 2/20 0.35
KMT2A Q03164 2/20 0.35
KDM4E B2RXH2 1/20 0.35
HPGD P15428 1/20 0.35
MPI P34949 1/20 0.35
MMP2 P08253 1/20 0.34
MMP3 P08254 1/20 0.34
MMP9 P14780 1/20 0.34
LMNA P02545 1/20 0.33
POLB P06746 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 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
SCHEMBL7968977 0.82 MAOB (0.36) CA12CA9DHFRALDH1A1MEN1
SCHEMBL7968952 0.82 KDM4E (0.38) GPR84CA12CA9DHFRALDH1A1
SCHEMBL7972384 0.79 KDM4E (0.35) GPR84DHFRALDH1A1MEN1MAPT
SCHEMBL7966642 0.77 CYP1A2 (0.41) DHFRTYMSALDH1A1MEN1MAPT
SCHEMBL7965270 0.75 DHFR (0.47) GPR84DHFRTYMSMMP2MMP3
SCHEMBL7972422 0.73 GPR84 (0.39) GPR84ALDH1A1MAPTKMT2AKDM4E
SCHEMBL6026174 0.72 ESR2 (0.40) TYMSALDH1A1MEN1MAPTKMT2A
SCHEMBL6026268 0.72 CFTR (0.39) TYMSALDH1A1MEN1MAPTKMT2A
SCHEMBL7955950 0.70 DHFR (0.49) DHFRTYMSALDH1A1KDM4EHPGD
SCHEMBL7956293 0.70 TLR8 (0.39) GPR84CA12CA9LMNA

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
US-6265436-B1 ANTIINFLAMMATORY AGENTS OXIS THERAPEUTICS INC. 2001-07-24 US disclosed