SCHEMBL4744841

SCHEMBL4744841

Cc1ccc(C2(c3noc(CNCCN4CCN(Cc5cccc(C(F)(F)F)c5)CC4)n3)CCC2)cc1C

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.39
KMT2A Q03164 5/20 0.39
ALDH1A1 P00352 2/20 0.39
KDM4E B2RXH2 1/20 0.39
GAA P10253 1/20 0.39
CACNA1G O43497 3/20 0.39
HTT P42858 2/20 0.38
PHGDH O43175 1/20 0.38
OPRL1 P41146 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
CARM1 Q86X55 1/20 0.36
PRMT6 Q96LA8 1/20 0.36
HTR2A P28223 1/20 0.35
HTR2C P28335 1/20 0.35
LMNA P02545 1/20 0.35

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 0.92 MEN1 (0.41) MEN1KMT2AALDH1A1KDM4EGAA
SCHEMBL4748756 0.91 MEN1 (0.47) MEN1KMT2AALDH1A1KDM4EGAA
SCHEMBL4744345 0.90 CACNA1G (0.43) MEN1KMT2AALDH1A1KDM4EGAA
SCHEMBL4744647 0.89 KDM4E (0.40) MEN1KMT2AALDH1A1KDM4EGAA
SCHEMBL4913486 0.89 MEN1 (0.43) MEN1KMT2AALDH1A1KDM4EGAA
SCHEMBL4747842 0.89 CACNA1G (0.43) MEN1KMT2AALDH1A1KDM4EGAA
SCHEMBL4802218 0.89 KDM4E (0.40) MEN1KMT2AALDH1A1KDM4EGAA
SCHEMBL4744227 0.88 MEN1 (0.42) MEN1KMT2AALDH1A1KDM4EGAA
SCHEMBL4748785 0.88 CACNA1G (0.43) MEN1KMT2AALDH1A1KDM4EGAA
SCHEMBL4747027 0.88 ALDH1A1 (0.40) MEN1KMT2AALDH1A1KDM4EGAA

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