SCHEMBL5329495

SCHEMBL5329495

FC(F)Oc1ccccc1-c1[c]cccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD1 P21728 1/20 0.45
KCNN4 O15554 4/20 0.36
ALDH1A1 P00352 3/20 0.35
KDM4E B2RXH2 2/20 0.35
TNF P01375 1/20 0.33
KMT2A Q03164 1/20 0.33
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MAPT P10636 1/20 0.31
EGFR P00533 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
HPGD P15428 1/20 0.30
ALOX15 P16050 1/20 0.30
CASP1 P29466 1/20 0.30
CASP7 P55210 1/20 0.30
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL3211338 0.82 SLC9A1 (0.39) KCNN4ALDH1A1KMT2AALOX15HSD17B10
SCHEMBL8802231 0.79 DRD1 (0.45) DRD1KCNN4ALDH1A1KDM4ETNF
SCHEMBL13729018 0.77 DRD1 (0.44) DRD1KCNN4ALDH1A1KDM4ETNF
SCHEMBL336434 0.76 APP (0.47) ALDH1A1KDM4EKMT2ASMN1; SMN2MAPT
SCHEMBL3141587 0.76
SCHEMBL5322053 0.75 ALDH1A1 (0.43) KCNN4ALDH1A1KDM4EMAPTCYP3A4
SCHEMBL6536573 0.75 DRD1 (0.45) DRD1KCNN4KDM4ECYP1A2CYP2C9
SCHEMBL16719971 0.73 DRD1 (0.41) DRD1KCNN4ALDH1A1KDM4ETNF
SCHEMBL2761711 0.73 MEN1 (0.32) ALDH1A1KDM4EKMT2AHTTSMN1; SMN2
SCHEMBL3879179 0.73 NCOA1 (0.43) ALDH1A1KMT2AHPGD

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007135527-A2 BENZIMIDAZOLYL COMPOUNDS PFIZER PRODUCTS INC. (US) 2007-11-29 WO claimed
WO-2007135529-A2 AZABENZIMIDAZOLYL COMPOUNDS AS MGLUR2 POTENTIATORS PFIZER PRODUCTS INC. (US) 2007-11-29 WO claimed
WO-2007135529-A2 AZABENZIMIDAZOLYL COMPOUNDS AS MGLUR2 POTENTIATORS PFIZER PRODUCTS INC. (US) 2007-11-29 WO disclosed
WO-2007135527-A2 BENZIMIDAZOLYL COMPOUNDS PFIZER PRODUCTS INC. (US) 2007-11-29 WO disclosed