SCHEMBL4748342

SCHEMBL4748342

FC(F)(F)c1cccc(C2CCN(CCNCc3nc(C4(c5ccc(Cl)c(Cl)c5)CC4)no3)CC2)c1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.44
HTT P42858 1/20 0.40
MEN1 O00255 1/20 0.39
ALDH1A1 P00352 1/20 0.39
KMT2A Q03164 1/20 0.39
GRM2 Q14416 2/20 0.39
DRD4 P21917 1/20 0.39
CACNA1G O43497 3/20 0.37
CHRM4 P08173 1/20 0.36
CCR2 P41597 2/20 0.35
CARM1 Q86X55 1/20 0.35
PRMT6 Q96LA8 1/20 0.35
CCR5 P51681 1/20 0.34
MCHR1 Q99705 2/20 0.34
PRCP P42785 1/20 0.34
KDM4A O75164 1/20 0.33
KDM4B O94953 1/20 0.33
KDM5C P41229 1/20 0.33
KDM5B Q9UGL1 1/20 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
SCHEMBL4744215 0.97 DRD2 (0.42) DRD2HTTMEN1ALDH1A1KMT2A
SCHEMBL4747795 0.92 DRD2 (0.47) DRD2HTTMEN1ALDH1A1KMT2A
SCHEMBL4744996 0.89 DRD2 (0.46) DRD2HTTMEN1ALDH1A1KMT2A
SCHEMBL4744655 0.89 DRD2 (0.46) DRD2HTTMEN1ALDH1A1KMT2A
SCHEMBL4744777 0.89 KMT2A (0.49) DRD2HTTMEN1ALDH1A1KMT2A
SCHEMBL4813265 0.89 DRD2 (0.43) DRD2HTTMEN1ALDH1A1KMT2A
SCHEMBL4746757 0.89 DRD2 (0.43) DRD2HTTMEN1ALDH1A1KMT2A
SCHEMBL4745089 0.89 DRD2 (0.45) DRD2HTTMEN1ALDH1A1KMT2A
SCHEMBL4746964 0.89 DRD2 (0.46) DRD2HTTMEN1ALDH1A1KMT2A
SCHEMBL4746778 0.88 DRD2 (0.44) DRD2HTTMEN1ALDH1A1KMT2A

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