SCHEMBL9045271

SCHEMBL9045271

[CH2]CCCc1c(CC)cccc1C(C)=O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 2/20 0.37
GABRB2 P47870 2/20 0.37
CLCN2 P51788 1/20 0.36
LTB4R Q15722 5/20 0.35
LTB4R2 Q9NPC1 3/20 0.35
HTT P42858 1/20 0.35
HSD17B1 P14061 1/20 0.34
F2R P25116 1/20 0.34
LMNA P02545 4/20 0.33
TSHR P16473 1/20 0.33
MAPT P10636 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ALDH1A1 P00352 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
IAPP P10997 1/20 0.33
KDM4E B2RXH2 1/20 0.32
BID P55957 1/20 0.32
BCL2L1 Q07817 1/20 0.32
MCL1 Q07820 1/20 0.32
BAK1 Q16611 1/20 0.32

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
SCHEMBL9047115 0.87 CLCN2 (0.45) GABRA1GABRB2CLCN2HTTALDH1A1
SCHEMBL9045526 0.83 BRPF1 (0.39) LMNAALDH1A1SMN1; SMN2KDM4E
SCHEMBL199686 0.82 GABRA1 (0.43) GABRA1GABRB2IAPPBIDBCL2L1
SCHEMBL10499032 0.82 GABRA1 (0.48) GABRA1GABRB2CLCN2HTTHSD17B1
SCHEMBL9045397 0.81 GABRA1 (0.35) GABRA1GABRB2CLCN2LTB4RLTB4R2
SCHEMBL9047503 0.81 AKR1B1 (0.41) HTTLMNATSHRMAPTALDH1A1
SCHEMBL9046816 0.81 KMT2A (0.41) ALDH1A1SMN1; SMN2KDM4E
SCHEMBL12475592 0.80 BID (0.43) HTTTSHRMAPTL3MBTL1IAPP
SCHEMBL7498472 0.80 LMNA (0.44) HTTLMNAMAPTL3MBTL1ALDH1A1
SCHEMBL9056727 0.78 GABRA1 (0.43) GABRA1GABRB2LMNATSHRMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0690854-A1 1-PHENYL-IMIDAZOL-2-ONE BIPHENYLMETHYL COMPOUNDS FOR TREATMENT OF CIRCULATORY DISORDERS G.D. SEARLE & CO. (US) 1996-01-10 EP claimed
EP-0690854-A1 1-PHENYL-IMIDAZOL-2-ONE BIPHENYLMETHYL COMPOUNDS FOR TREATMENT OF CIRCULATORY DISORDERS G.D. SEARLE & CO. (US) 1996-01-10 EP disclosed
EP-0664802-A1 N-ARYLHETEROARYLALKYL 1-PHENYL-IMIDAZOL-2-ONE COMPOUNDS FOR TREATMENT OF CIRCULATORY DISORDERS G.D. SEARLE & CO. (US) 1995-08-02 EP disclosed