SCHEMBL4744227

SCHEMBL4744227

Cc1cccc(C2(c3noc(CNCCN4CCN(Cc5cccc(C(F)(F)F)c5)CC4)n3)CC2)c1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
PHGDH O43175 1/20 0.41
CACNA1G O43497 4/20 0.40
UBE2M P61081 1/20 0.39
DCUN1D1 Q96GG9 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
GAA P10253 1/20 0.39
OPRL1 P41146 2/20 0.38
HTT P42858 2/20 0.38
CARM1 Q86X55 1/20 0.38
PRMT6 Q96LA8 1/20 0.38
CNR2 P34972 1/20 0.38
LMNA P02545 1/20 0.37

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
SCHEMBL4744995 0.97 MEN1 (0.41) MEN1KMT2APHGDHCACNA1GUBE2M
SCHEMBL4913486 0.93 MEN1 (0.43) MEN1KMT2APHGDHCACNA1GKDM4E
SCHEMBL4748756 0.90 MEN1 (0.47) MEN1KMT2APHGDHCACNA1GKDM4E
SCHEMBL4748785 0.89 CACNA1G (0.43) MEN1KMT2ACACNA1GKDM4EALDH1A1
SCHEMBL4744345 0.89 CACNA1G (0.43) MEN1KMT2ACACNA1GKDM4EALDH1A1
SCHEMBL4744841 0.88 MEN1 (0.39) MEN1KMT2APHGDHCACNA1GKDM4E
SCHEMBL4744706 0.88 CACNA1G (0.41) MEN1KMT2ACACNA1GUBE2MDCUN1D1
SCHEMBL4747809 0.88 CACNA1G (0.44) MEN1KMT2ACACNA1GKDM4EALDH1A1
SCHEMBL4802218 0.88 KDM4E (0.40) MEN1KMT2ACACNA1GUBE2MDCUN1D1
SCHEMBL4744963 0.88 KDM4E (0.40) MEN1KMT2ACACNA1GUBE2MDCUN1D1

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
WO-2008117148-A1 SUBSTITUTED OXADIAZOLE ANALOGS AS CALCIUM CHANNEL ANTAGONISTS PFIZER PRODUCTS INC. (US) 2008-10-02 WO disclosed