SCHEMBL6030940

SCHEMBL6030940

Cc1ccccc1N1CCN(C(Cl)c2ccccc2)CC1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ADRB1 P08588 1/20 0.49
LMNA P02545 1/20 0.48
MCOLN3 Q8TDD5 1/20 0.48
HTR7 P34969 1/20 0.43
ALDH1A1 P00352 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
HPGD P15428 1/20 0.43
AR P10275 2/20 0.43
AKR1C3 P42330 1/20 0.42
SLC18A3 Q16572 1/20 0.42
HTT P42858 1/20 0.42
CYP2D6 P10635 1/20 0.42
ATM Q13315 2/20 0.41
KMT2A Q03164 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
SCHEMBL6411602 0.83 HTR1A (0.52) ADRB1LMNAALDH1A1SMN1; SMN2AKR1C3
SCHEMBL4291189 0.78 ADRB1 (0.72) ADRB1LMNAMCOLN3HTR7ALDH1A1
SCHEMBL14983590 0.78 ADRB1 (0.56) ADRB1LMNAMCOLN3HTR7ALDH1A1
SCHEMBL6031006 0.77 MAPT (0.48) ADRB1HTR7ALDH1A1SMN1; SMN2
SCHEMBL6806256 0.77 ADRB1 (0.47) ADRB1HTR7ALDH1A1SMN1; SMN2HTT
SCHEMBL6031040 0.74 MAPT (0.52) ADRB1LMNAHTR7ALDH1A1SMN1; SMN2
SCHEMBL28587090 0.73 ADRB1 (0.60) ADRB1LMNAMCOLN3HTR7ALDH1A1
SCHEMBL6736376 0.73 ADRB1 (0.60) ADRB1LMNAMCOLN3HTR7ALDH1A1
SCHEMBL11211339 0.73 ATM (0.53) ADRB1LMNAMCOLN3ALDH1A1AR
SCHEMBL8690323 0.73 ALDH1A1 (0.63) ADRB1LMNAALDH1A1ARHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7101887-B2 1-phenyl-4-benzylpiperazines dopamine receptor subtype specific ligands NEUROGEN CORPORATION (US) 2006-09-05 US disclosed
US-20050239799-A1 1-phenyl-4-benzylpiperazines dopamine receptor subtype NEUROGEN CORPORATION (US) 2005-10-27 US 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 (1 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-20050239799-A1 1-phenyl-4-benzylpiperazines dopamine receptor subtype DRD2, DRD4, HTR2C ADRB1 113/4885LMNA 3652/4885MCOLN3 2235/4885

“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.