SCHEMBL5657239

SCHEMBL5657239

Clc1ccccc1N1CCN(CCCCN2CCc3ccccc32)CC1

nearest known ligand 0.73

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 10/20 0.73
DRD2 P14416 9/20 0.73
DRD1 P21728 6/20 0.73
ADRA1A P35348 3/20 0.63
ADRA1B P35368 3/20 0.63
KDM4E B2RXH2 1/20 0.62
LMNA P02545 1/20 0.62
MEN1 O00255 1/20 0.57
USP2 O75604 1/20 0.57
ALDH1A1 P00352 1/20 0.57
CDK4 P11802 1/20 0.57
ALOX15 P16050 1/20 0.57
CCND1 P24385 1/20 0.57
KMT2A Q03164 1/20 0.57
DRD4 P21917 3/20 0.56
HTR2A P28223 1/20 0.56
ADRA1D P25100 2/20 0.53

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
SCHEMBL5655844 0.92 DRD3 (0.76) DRD3DRD2DRD1ADRA1AADRA1B
SCHEMBL5656983 0.91 DRD3 (0.74) DRD3DRD2DRD1ADRA1AADRA1B
SCHEMBL5656296 0.90 DRD3 (0.76) DRD3DRD2DRD1ADRA1AADRA1B
Hydrochloric Acid SCHEMBL28739470 0.89 DRD3 (0.74) DRD3DRD2DRD1ADRA1AADRA1B
SCHEMBL5656309 0.82 KCNH2 (0.67) DRD3DRD2DRD1DRD4HTR2A
SCHEMBL9785952 0.82 DRD2 (0.76) DRD3DRD2DRD1MEN1KMT2A
SCHEMBL5657064 0.79 MAPT (0.64) DRD3DRD2DRD1KDM4ELMNA
SCHEMBL11273863 0.78 KDM4E (0.70) DRD3DRD2DRD1ADRA1AADRA1B
SCHEMBL3194731 0.78 KDM4E (0.70) DRD3DRD2DRD1ADRA1AADRA1B
SCHEMBL7328095 0.77 KDM4E (0.69) DRD3DRD2DRD1ADRA1AADRA1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7223765-B2 4-phenyl-1-piperazinyl, -piperidinyl and -tetrahydropyridyl derivatives H. LUNDBECK A/S (DK) 2007-05-29 US claimed
US-20060148815-A1 4-Phenyl-1-piperazinyl, -piperidinyl and-tetrahydropyridyl derivatives H. LUNDBECK A/S (DK) 2006-07-06 US claimed
US-7223765-B2 4-phenyl-1-piperazinyl, -piperidinyl and -tetrahydropyridyl derivatives H. LUNDBECK A/S (DK) 2007-05-29 US disclosed
CN-1803784-A 4-phenyl-1-piperazinyl, -piperidinyl and -tetrahydropyridyl derivatives LUNDBECK CO AS H (DK) 2006-07-19 CN disclosed
US-7074796-B2 4-phenyl-1-piperazinyl, -piperidinyl and -tetrahydropyridyl derivatives H. LUNDBECK A/S (DK) 2006-07-11 US disclosed
US-20060148815-A1 4-Phenyl-1-piperazinyl, -piperidinyl and-tetrahydropyridyl derivatives H. LUNDBECK A/S (DK) 2006-07-06 US disclosed
CN-1244577-C 4-phenyl-1-piperazinyl, -piperidinyl and-tetrahydropyridinyl derivatives LUNDBECK & CO AS H (DK) 2006-03-08 CN disclosed
EP-1464641-A1 4-Phenyl-piperazinyl, -piperidinyl and tetrahydropyridyl derivatives as dopamine D4 antagonists H. Lundbeck A/S (DK) 2004-10-06 EP disclosed
EP-1246817-B1 4-PHENYL-1-PIPERAZINYL, -PIPERIDINYL AND -TETRAHYDROPYRIDYL DERIVATIVES LUNDBECK & CO AS H (DK) 2004-06-23 EP disclosed
CN-1434819-A 4-phenyl-1-piperazinyl, -piperidinyl and-tetrahydropyridinyl derivatives LUNDBECK & CO AS H (DK) 2003-08-06 CN disclosed
US-20030027832-A1 4-Phenyl-1-piperazinyl, -piperidinyl and -tetrahydropyridyl derivatives H. LUNDBECK A/S (DK) 2003-02-06 US disclosed
EP-1246817-A1 4-PHENYL-1-PIPERAZINYL, -PIPERIDINYL AND -TETRAHYDROPYRIDYL DERIVATIVES H. Lundbeck A/S (DK) 2002-10-09 EP disclosed
WO-2001049679-A1 4-PHENYL-1-PIPERAZINYL, -PIPERIDINYL AND -TETRAHYDROPYRIDYL DERIVATIVES H. LUNDBECK A/S (DK) 2001-07-12 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060148815-A1 4-Phenyl-1-piperazinyl, -piperidinyl and-tetrahydropyridyl derivatives OPRD1, VDR, GPR4 DRD3 22/4885DRD2 27/4885DRD1 56/4885
US-20030027832-A1 4-Phenyl-1-piperazinyl, -piperidinyl and -tetrahydropyridyl derivatives OPRD1, DRD3, DRD2 DRD3 2/4885DRD2 3/4885DRD1 5/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.