SCHEMBL6474033

SCHEMBL6474033

Cc1ccc(N2CCN(CCCN3C(=O)C4CC=CCC4C3=O)CC2)cc1C

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 4/20 0.60
DRD4 P21917 5/20 0.50
DRD2 P14416 7/20 0.49
DRD3 P35462 2/20 0.49
HTR1A P08908 6/20 0.48
HTR2A P28223 3/20 0.48
ALDH1A1 P00352 2/20 0.45
POLB P06746 1/20 0.45
HTR6 P50406 2/20 0.43
KDM4E B2RXH2 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
ADRB1 P08588 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
Hydrochloric Acid SCHEMBL7610245 0.99 HTR7 (0.59) HTR7DRD4DRD2DRD3HTR1A
SCHEMBL6475262 0.91 HTR7 (0.58) HTR7DRD4DRD2DRD3HTR1A
Hydrochloric Acid SCHEMBL7100442 0.90 HTR7 (0.57) HTR7DRD4DRD2DRD3HTR1A
SCHEMBL6474401 0.81 HTR7 (0.60) HTR7DRD2HTR1AHTR2AKDM4E
SCHEMBL6475395 0.81 HTR1A (0.67) HTR7DRD4DRD2DRD3HTR1A
SCHEMBL6860233 0.81 DRD4 (0.52) HTR7DRD4DRD2DRD3HTR1A
SCHEMBL6474190 0.81 HTR7 (0.69) HTR7DRD4DRD2DRD3HTR1A
SCHEMBL6474706 0.81 HTR7 (0.60) HTR7DRD4DRD2DRD3HTR1A
Hydrochloric Acid SCHEMBL7613022 0.81 HTR7 (0.59) HTR7DRD4DRD2HTR1AHTR2A
SCHEMBL6483189 0.81 HTR7 (0.56) HTR7DRD2HTR1AHTR2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6914064-B2 1,4-Disubstituted piperazine derivatives useful as uro-selective α1-adrenoceptor blockers RANBAXY LABORATORIES LIMITED (IN) 2005-07-05 US claimed
US-20020156085-A1 1,4-Disubstituted piperazine derivatives useful as uro-selective alpha1-adrenoceptor blockers RANBAXY LABORATORIES LIMITED (IN) 2002-10-24 US claimed
US-6914064-B2 1,4-Disubstituted piperazine derivatives useful as uro-selective α1-adrenoceptor blockers RANBAXY LABORATORIES LIMITED (IN) 2005-07-05 US disclosed
US-20020156085-A1 1,4-Disubstituted piperazine derivatives useful as uro-selective alpha1-adrenoceptor blockers RANBAXY LABORATORIES LIMITED (IN) 2002-10-24 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-20020156085-A1 1,4-Disubstituted piperazine derivatives useful as uro-selective alpha1-adrenoceptor blockers ADRB1, ADRB2, ADRA1B HTR7 426/4885DRD4 1105/4885DRD2 491/4885

“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.