SCHEMBL9568039

SCHEMBL9568039

O=C(CC1CCCc2ccccc21)NC(c1ccccc1)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
UGCG Q16739 1/20 0.52
ALDH1A1 P00352 4/20 0.46
LMNA P02545 1/20 0.46
KDM4C Q9H3R0 3/20 0.45
KDM5A P29375 2/20 0.45
KDM5B Q9UGL1 2/20 0.45
PDPK1 O15530 1/20 0.45
KMT2A Q03164 2/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
HTT P42858 1/20 0.44
MEN1 O00255 1/20 0.43
SLC6A4 P31645 1/20 0.43
SLC6A3 Q01959 1/20 0.43
TSHR P16473 2/20 0.43
PRMT5 O14744 1/20 0.43
WDR77 Q9BQA1 1/20 0.43
HPGD P15428 1/20 0.43
MTNR1B P49286 1/20 0.43

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
SCHEMBL9567998 0.92 PRMT5 (0.49) UGCGALDH1A1LMNAKMT2AL3MBTL1
SCHEMBL9567963 0.88 ALDH1A1 (0.44) ALDH1A1LMNAKDM4CKDM5AKDM5B
SCHEMBL9568000 0.85 ALDH1A1 (0.43) ALDH1A1LMNAKDM4CKDM5AKDM5B
SCHEMBL9567971 0.85 PRMT5 (0.53) UGCGALDH1A1KDM4CKDM5AKDM5B
SCHEMBL9568008 0.84 ALDH1A1 (0.51) UGCGALDH1A1KDM4CKDM5AKDM5B
SCHEMBL9567986 0.81 UGCG (0.50) UGCGALDH1A1KDM4CKDM5AKDM5B
SCHEMBL9567955 0.81 CNR1 (0.48) UGCGALDH1A1KDM4CKDM5AKDM5B
SCHEMBL9050611 0.80 KMT2A (0.44) UGCGALDH1A1LMNAKDM4CKMT2A
SCHEMBL9568029 0.79 TAOK1 (0.49) ALDH1A1KDM4CKDM5AKDM5BKMT2A
SCHEMBL3590904 0.79 FFAR1 (0.52) ALDH1A1KDM4CKDM5AKDM5BKMT2A

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-0542203-A2 Fused benzeneoxyacetic acid derivatives as PGl2 receptor agonists ONO PHARMACEUTICAL CO., LTD. (JP) 1993-05-19 EP claimed
EP-0542203-A2 Fused benzeneoxyacetic acid derivatives as PGl2 receptor agonists ONO PHARMACEUTICAL CO., LTD. (JP) 1993-05-19 EP disclosed