SCHEMBL7311359

SCHEMBL7311359

CCC(=O)N1CCCC(c2cccc(C(=O)OC)c2)C1

nearest known ligand 0.72

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 3/20 0.54
ALDH1A1 P00352 2/20 0.46
LMNA P02545 1/20 0.46
HPGD P15428 1/20 0.46
HIF1A Q16665 1/20 0.46
KMT2A Q03164 3/20 0.46
MEN1 O00255 2/20 0.46
RHOA P61586 1/20 0.45
DRD2 P14416 2/20 0.45
MYC P01106 1/20 0.45
PROKR1 Q8TCW9 1/20 0.45
ACHE P22303 1/20 0.44
EPHX2 P34913 1/20 0.44
SIGMAR1 Q99720 3/20 0.44
DRD4 P21917 2/20 0.44
NFKB1 P19838 1/20 0.44
PRCP P42785 1/20 0.44
EBP Q15125 1/20 0.44
PPARA Q07869 1/20 0.43

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
SCHEMBL7312670 0.87 KMO (0.58) DRD3ALDH1A1LMNAHPGDHIF1A
SCHEMBL7346632 0.86 DRD3 (0.62) DRD3DRD2ACHESIGMAR1DRD4
SCHEMBL7357645 0.84 DRD3 (0.77) DRD3DRD2ACHESIGMAR1DRD4
SCHEMBL7355460 0.84 DRD3 (0.77) DRD3DRD2ACHESIGMAR1DRD4
SCHEMBL7347560 0.83 DRD3 (0.55) DRD3ALDH1A1LMNAHPGDHIF1A
SCHEMBL7353501 0.82 DRD3 (0.67) DRD3DRD2ACHESIGMAR1DRD4
SCHEMBL20658828 0.81 RBP4 (0.49) DRD3ALDH1A1LMNAHPGDHIF1A
SCHEMBL14035659 0.80 ALDH1A1 (0.61) DRD3ALDH1A1LMNAHPGDHIF1A
SCHEMBL8414748 0.79 KMO (0.64) DRD3ALDH1A1HPGDKMT2A
SCHEMBL26154174 0.79 KMO (0.59) DRD3ALDH1A1HPGDKMT2A

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-4937346-A Phenyl-azacykloalkanes Carlsson, Per Arvid Emil (SE) 1990-06-26 US disclosed
US-4719219-A Phenyl-azacycloalkanes and use thereof in treatment of central nervous system disorders Carlsson, Per A. E. (SE) 1988-01-12 US disclosed
US-4426386-A CNS DISORDERS ASTRA LAKEMEDEL AKTIEBOLAG (SE) 1984-01-17 US disclosed
EP-0084920-A2 New compounds useful as intermediates or starting materials for preparation of therapeutically useful phenyl-azacycloalkanes Carlsson, Per Arvid Emil (SE) 1983-08-03 EP disclosed
EP-0030526-A1 New phenyl-azacycloalkanes, processes for preparation and pharmaceutical preparations for such compounds Astra Läkemedel Aktiebolag (SE) 1981-06-17 EP disclosed
WO-1981001552-A1 NEW PHENYL-AZACYCLOALKANES ASTRA LAEKEMEDEL AB (SE) 1981-06-11 WO disclosed