SCHEMBL8970482

SCHEMBL8970482

CCOC(=O)c1c(N2CCC(C)CC2)n(CC)c2c(OC(F)F)c(N3CCN(c4ncccn4)CC3)c(F)cc2c1=O

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
KDM4E B2RXH2 2/20 0.33
CDC7 O00311 1/20 0.33
RECQL P46063 1/20 0.33
GPR174 Q9BXC1 1/20 0.32
FFAR4 Q5NUL3 1/20 0.32
GAA P10253 1/20 0.32
TSHR P16473 1/20 0.32
HSD17B10 Q99714 1/20 0.32
DYRK1A Q13627 1/20 0.32

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
SCHEMBL8877789 0.79 KDM4E (0.47) MEN1KMT2AKDM4EHSD17B10
SCHEMBL8877142 0.77 KDM4E (0.39) KDM4EHSD17B10
SCHEMBL8733968 0.74 IKBKB (0.34)
SCHEMBL8736445 0.73 KDM4E (0.50) MEN1KMT2AKDM4ETSHRHSD17B10
SCHEMBL8879095 0.70 KDM4E (0.48) KDM4ERECQLHSD17B10
SCHEMBL537485 0.70 KCNH2 (0.37) KDM4EHSD17B10
SCHEMBL8880495 0.70 HTR4 (0.40) MEN1KMT2AKDM4EGAAHSD17B10
SCHEMBL8735573 0.70 KDM4E (0.36) KDM4ERECQLHSD17B10
SCHEMBL8878712 0.70 KCNH2 (0.55) MEN1KMT2AKDM4EHSD17B10
SCHEMBL8732186 0.69 KDM4E (0.45) MEN1KMT2AKDM4EGAAHSD17B10

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
US-5519016-A Aryl group- or aromatic heterocyclic group-substituted aminoquinolone derivatives and anti-HIV agent UBE INDUSTRIES, LTD. (JP) 1996-05-21 US claimed
US-5519016-A Aryl group- or aromatic heterocyclic group-substituted aminoquinolone derivatives and anti-HIV agent UBE INDUSTRIES, LTD. (JP) 1996-05-21 US disclosed