SCHEMBL31314522

SCHEMBL31314522

c1cc(C2CCCCC2)[nH]c1C1CCCCC1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DAO P14920 2/20 0.45
NPY5R Q15761 2/20 0.41
CSF1R P07333 1/20 0.37
GCGR P47871 1/20 0.37
MAPK14 Q16539 1/20 0.37
CYP11B2 P19099 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
KDM5A P29375 1/20 0.35
KDM5B Q9UGL1 1/20 0.35
MAPT P10636 2/20 0.34
HAO1 Q9UJM8 1/20 0.34
KDM4E B2RXH2 1/20 0.34
GFER P55789 1/20 0.34
HSP90AA1 P07900 1/20 0.33
GAA P10253 1/20 0.33
KMT2A Q03164 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
YTHDF3 Q7Z739 1/20 0.33
YTHDF1 Q9BYJ9 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
SCHEMBL17193276 0.80 DAO (0.36) DAONPY5RCSF1RGCGRMAPK14
SCHEMBL17016660 0.77 DAO (0.46) DAONPC1RAB9AMAPTKDM4E
SCHEMBL15614393 0.77 DAO (0.46) DAOKDM5AKDM5BHSP90AA1
SCHEMBL11840491 0.77 DAO (0.46) DAONPY5RCSF1RGCGRMAPT
SCHEMBL12337507 0.74 CDC7 (0.49) DAONPY5RCSF1RGCGRMAPK14
SCHEMBL11833334 0.73 KDM5A (0.47) DAOKDM5AKDM5BKDM4EGAA
SCHEMBL11840483 0.73 DAO (0.42) DAOGCGRMAPK14KDM4EGAA
SCHEMBL11840536 0.73 KDM4E (0.44) DAOKDM4EGAAKMT2A
SCHEMBL2361010 0.70 DAO (0.39) DAONPY5RCYP11B2MAPTKDM4E
SCHEMBL29187228 0.70 DAO (0.39) DAONPY5RCYP11B2MAPTKDM4E

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
CN-119463010-A Pellets, molded article, and method for producing molded article 旭化成株式会社 2025-02-18 CN disclosed