SCHEMBL4532899

SCHEMBL4532899

C=CCNC(=O)c1ccc(-c2ccc3c(c2)COC(C2CCN(C(=O)OCC4(C)CC4)CC2)O3)cc1

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.36
RAB9A P51151 2/20 0.36
MAPT P10636 1/20 0.36
POLB P06746 2/20 0.35
LMNA P02545 1/20 0.34
GAA P10253 1/20 0.34
PKM P14618 1/20 0.33
ALDH1A1 P00352 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
GPR119 Q8TDV5 4/20 0.32
ENPP2 Q13822 1/20 0.32
CHRM5 P08912 2/20 0.32
CHRM2 P08172 1/20 0.32
CHRM3 P20309 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
ROCK2 O75116 1/20 0.32
CHRM1 P11229 1/20 0.31

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
SCHEMBL4358519 0.91 KDM4E (0.41) KDM4ERAB9AMAPTPOLBLMNA
SCHEMBL4350015 0.91 GPR119 (0.41) KDM4EGAAALDH1A1SMN1; SMN2GPR119
SCHEMBL4350129 0.89 KDM4E (0.37) KDM4ERAB9ALMNAALDH1A1SMN1; SMN2
SCHEMBL4353425 0.89 SCD5 (0.36) KDM4EALDH1A1SMN1; SMN2GPR119ENPP2
SCHEMBL4352065 0.89 ALDH1A1 (0.39) KDM4EMAPTLMNAGAAALDH1A1
SCHEMBL4348559 0.88 MAPK14 (0.37) KDM4EALDH1A1SMN1; SMN2GPR119CHRM5
SCHEMBL4353651 0.88 KCNH2 (0.38) RAB9AMAPTALDH1A1SMN1; SMN2ENPP2
SCHEMBL4351363 0.87 GPR119 (0.46) KDM4ERAB9APOLBPKMGPR119
SCHEMBL4522943 0.86 ALDH1A1 (0.36) KDM4ERAB9AMAPTPKMALDH1A1
SCHEMBL4534628 0.86 GPR119 (0.40) GPR119CHRM2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009150144-A1 NEW GPR119MODULATORS INOVACIA AB (SE) 2009-12-17 WO claimed
WO-2009150144-A1 NEW GPR119MODULATORS INOVACIA AB (SE) 2009-12-17 WO disclosed
WO-2009150144-A1 NEW GPR119MODULATORS INOVACIA AB (SE) 2009-12-17 WO disclosed