SCHEMBL8918938

SCHEMBL8918938

CN(CCc1ccccc1)C1CCN(C(=O)c2ccc3[nH]c(=O)ccc3c2)CC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 2/20 0.48
PDE3A Q14432 2/20 0.48
DRD4 P21917 3/20 0.48
MAPK14 Q16539 2/20 0.46
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
GRIN2D O15399 1/20 0.43
GRIN3B O60391 1/20 0.43
GRIN1 Q05586 1/20 0.43
GRIN2A Q12879 1/20 0.43
GRIN2B Q13224 1/20 0.43
GRIN2C Q14957 1/20 0.43
GRIN3A Q8TCU5 1/20 0.43
CHIA Q9BZP6 1/20 0.43
TP53 P04637 1/20 0.42
LMNA P02545 1/20 0.42
MGLL Q99685 1/20 0.42
POLB P06746 1/20 0.41

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
SCHEMBL7284840 0.90 PDE3B (0.52) PDE3BPDE3ADRD4MAPK14MEN1
SCHEMBL8917647 0.87 MEN1 (0.46) DRD4MAPK14MEN1KMT2AGRIN2D
Hydrochloric Acid SCHEMBL8921537 0.85 PDE3B (0.53) PDE3BPDE3AMEN1KMT2ARAB9A
SCHEMBL8919087 0.85 DRD4 (0.42) DRD4MEN1KMT2ANPC1RAB9A
Hydrochloric Acid SCHEMBL7471638 0.85 MEN1 (0.46) DRD4MAPK14MEN1KMT2ANPC1
SCHEMBL8920236 0.84 DRD4 (0.41) DRD4MEN1KMT2ANPC1RAB9A
SCHEMBL8922159 0.84 MEN1 (0.43) DRD4MAPK14MEN1KMT2ANPC1
Hydrochloric Acid SCHEMBL8919208 0.84 DRD4 (0.41) DRD4MEN1KMT2ANPC1RAB9A
SCHEMBL8918884 0.83 MAPK14 (0.51) MAPK14MEN1KMT2ANPC1GRIN2D
Hydrochloric Acid SCHEMBL8919801 0.83 MEN1 (0.42) DRD4MAPK14MEN1KMT2ANPC1

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
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