SCHEMBL5867340

SCHEMBL5867340

CCN(CC)CCNCc1ccc(-c2cc(F)c(C)c(F)c2F)cn1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ S1PR1 P21453 3/20 0.39
▸ MEN1 O00255 2/20 0.36
▸ LMNA P02545 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ KDR P35968 5/20 0.35
▸ CSF1R P07333 3/20 0.35
▸ PDGFRB P09619 3/20 0.35
▸ FLT3 P36888 3/20 0.35
▸ EGFR P00533 2/20 0.35
▸ KIT P10721 2/20 0.35
▸ FGFR1 P11362 2/20 0.35
▸ HTT P42858 2/20 0.34
▸ USP2 O75604 1/20 0.34
▸ CD274 Q9NZQ7 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ PRKAA1 Q13131 3/20 0.33
▸ PLK4 O00444 2/20 0.33
▸ DCLK1 O15075 2/20 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
SCHEMBL3537091 0.82 CD274 (0.41) S1PR1MEN1LMNAKMT2AKDM4E
SCHEMBL3540616 0.79 SMN1; SMN2 (0.39) S1PR1MEN1LMNAKMT2AKDM4E
SCHEMBL3540435 0.79 CD274 (0.42) MEN1LMNAKMT2AKDM4EMAPK1
SCHEMBL4844832 0.75 CD274 (0.42) MEN1LMNAKMT2AKDM4ECD274
SCHEMBL4424582 0.74 HTT (0.53) S1PR1MEN1LMNAKMT2AKDM4E
SCHEMBL6312390 0.74 MCHR1 (0.43) S1PR1MEN1LMNAKMT2AHTT
SCHEMBL6313158 0.69 SMN1; SMN2 (0.41) S1PR1MEN1LMNAKMT2AKDM4E
SCHEMBL3542036 0.67 MEN1 (0.39) MEN1LMNAKMT2AKDM4EMAPK1
SCHEMBL5642194 0.65 PARP1 (0.37) S1PR1MEN1KMT2ACD274OPRM1
SCHEMBL6304885 0.65 CD274 (0.44) LMNAKDM4EHTTCD274CHRM2

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-7115616-B2 Pyrimidinone compounds SMITHKLINE BEECHAM PLC (GB) 2006-10-03 — — US disclosed
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