SCHEMBL4748322

SCHEMBL4748322

Fc1ccccc1C1(c2noc(CNCCN3CCN(Cc4cccc(C(F)(F)F)c4)CC3)n2)CCCC1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CACNA1G O43497 3/20 0.41
OPRL1 P41146 1/20 0.41
GAA P10253 2/20 0.40
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.38
FAAH O00519 1/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
MAPK1 P28482 1/20 0.37
HTT P42858 1/20 0.36
HTR2A P28223 1/20 0.36
HTR2C P28335 1/20 0.36
DRD4 P21917 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL4748785 0.90 CACNA1G (0.43) CACNA1GOPRL1GAAKDM4EALDH1A1
SCHEMBL4744345 0.88 CACNA1G (0.43) CACNA1GOPRL1GAAKDM4EALDH1A1
SCHEMBL4748620 0.86 DRD2 (0.44) CACNA1GALDH1A1MEN1KMT2AHTT
SCHEMBL4747027 0.86 ALDH1A1 (0.40) CACNA1GOPRL1GAAKDM4EALDH1A1
SCHEMBL4748756 0.86 MEN1 (0.47) CACNA1GOPRL1GAAKDM4EALDH1A1
SCHEMBL4744963 0.85 KDM4E (0.40) CACNA1GOPRL1GAAKDM4EALDH1A1
SCHEMBL4748172 0.85 ALDH1A1 (0.42) CACNA1GOPRL1GAAKDM4EALDH1A1
SCHEMBL4744647 0.84 KDM4E (0.40) CACNA1GOPRL1GAAKDM4EALDH1A1
SCHEMBL4747811 0.84 CACNA1G (0.43) CACNA1GOPRL1GAAKDM4EALDH1A1
SCHEMBL4744995 0.84 MEN1 (0.41) CACNA1GOPRL1GAAKDM4EALDH1A1

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