SCHEMBL8919087

SCHEMBL8919087

Cc1cc(C(=O)N2CCC(N(C)CCc3ccccc3)CC2)cc2ccc(=O)[nH]c12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 3/20 0.42
CHIA Q9BZP6 1/20 0.41
ACACB O00763 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
MEN1 O00255 4/20 0.38
KMT2A Q03164 4/20 0.38
HSD11B1 P28845 1/20 0.38
NPBWR1 P48145 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MCHR1 Q99705 1/20 0.38
GRIN2D O15399 2/20 0.38
GRIN3B O60391 2/20 0.38
GRIN1 Q05586 2/20 0.38
GRIN2A Q12879 2/20 0.38
GRIN2B Q13224 2/20 0.38
GRIN2C Q14957 2/20 0.38
GRIN3A Q8TCU5 2/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
HRH3 Q9Y5N1 1/20 0.37

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
SCHEMBL8920236 0.90 DRD4 (0.41) DRD4CHIAL3MBTL1MEN1KMT2A
SCHEMBL8922159 0.89 MEN1 (0.43) DRD4CHIAMEN1KMT2ANPC1
Hydrochloric Acid SCHEMBL8919208 0.89 DRD4 (0.41) DRD4CHIAL3MBTL1MEN1KMT2A
Hydrochloric Acid SCHEMBL8919801 0.89 MEN1 (0.42) DRD4CHIAMEN1KMT2ANPC1
Hydrochloric Acid SCHEMBL8919880 0.88 DRD4 (0.40) DRD4CHIAL3MBTL1MEN1KMT2A
Hydrochloric Acid SCHEMBL8920956 0.86 HTT (0.45) DRD4CHIAL3MBTL1MEN1KMT2A
SCHEMBL8918938 0.85 PDE3B (0.48) DRD4CHIAMEN1KMT2AGRIN2D
SCHEMBL8917647 0.80 MEN1 (0.46) DRD4CHIAMEN1KMT2AHSD11B1
Oxalic Acid SCHEMBL7464359 0.80 CHIA (0.46) DRD4CHIAL3MBTL1MEN1KMT2A
Hydrochloric Acid SCHEMBL7464856 0.78 CHIA (0.45) DRD4CHIAL3MBTL1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5591751-A CARBOSTYRIL DERIVATIVES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1997-01-07 US claimed
EP-0636128-A1 PIPERAZINOCARBONYLCARBOSTYRILS AS PERIPHERAL VASODILATORS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1995-02-01 EP claimed
WO-1994019339-A1 PIPERAZINOCARBONYLCARBOSTYRILS AS PERIPHERAL VASODILATORS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1994-09-01 WO claimed
US-5591751-A CARBOSTYRIL DERIVATIVES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1997-01-07 US disclosed
EP-0636128-A1 PIPERAZINOCARBONYLCARBOSTYRILS AS PERIPHERAL VASODILATORS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1995-02-01 EP disclosed
WO-1994019339-A1 PIPERAZINOCARBONYLCARBOSTYRILS AS PERIPHERAL VASODILATORS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1994-09-01 WO disclosed