SCHEMBL8213356

SCHEMBL8213356

FC(F)(F)c1ccc(N2CCN(Cc3nc(C4(c5ccccc5)CCCCC4)no3)CC2)nc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 1/20 0.48
DRD4 P21917 1/20 0.47
GRM2 Q14416 1/20 0.47
KMT2A Q03164 4/20 0.45
MEN1 O00255 3/20 0.45
HTT P42858 3/20 0.45
LMNA P02545 3/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
ALDH1A1 P00352 2/20 0.43
MAPT P10636 2/20 0.42
CHRM2 P08172 1/20 0.42
CHRM1 P11229 1/20 0.42
DGAT1 O75907 1/20 0.42
SMO Q99835 3/20 0.40
PPARG P37231 1/20 0.40
PPARD Q03181 1/20 0.40
PPARA Q07869 1/20 0.40
HPGD P15428 1/20 0.40
TSHR P16473 1/20 0.40
HSD17B10 Q99714 1/20 0.40

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
SCHEMBL8221642 0.99 DRD4 (0.48) HTR7DRD4GRM2KMT2AMEN1
SCHEMBL8220785 0.97 DRD4 (0.48) HTR7DRD4GRM2KMT2AMEN1
SCHEMBL8221663 0.95 DRD4 (0.49) HTR7DRD4GRM2KMT2AMEN1
SCHEMBL8220527 0.92 HTR7 (0.47) HTR7DRD4GRM2KMT2AMEN1
SCHEMBL8224009 0.92 KMT2A (0.47) HTR7DRD4GRM2KMT2AMEN1
SCHEMBL8221246 0.91 KMT2A (0.56) HTR7DRD4GRM2KMT2AMEN1
SCHEMBL4575368 0.91 KMT2A (0.47) HTR7DRD4GRM2KMT2AMEN1
SCHEMBL8221394 0.89 ALDH1A1 (0.46) HTR7DRD4GRM2KMT2AMEN1
SCHEMBL4575198 0.87 LMNA (0.46) HTR7DRD4GRM2KMT2AMEN1
SCHEMBL4744984 0.87 HTR7 (0.46) HTR7DRD4GRM2KMT2AHTT

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-2008050200-A1 OXADIAZOLE COMPOUNDS AS CALCIUM CHANNEL ANTAGONISTS PFIZER PRODUCTS INC. (US) 2008-05-02 WO disclosed