SCHEMBL16634073

SCHEMBL16634073

CN(CCCN1CCN(c2cccc(Cl)c2)CC1)c1cccc(C#N)c1

nearest known ligand 0.71

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 11/20 0.71
DRD2 P14416 2/20 0.58
DRD3 P35462 1/20 0.58
KCNH2 Q12809 1/20 0.56
SIGMAR1 Q99720 1/20 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
SCHEMBL15326095 0.94 HTR7 (0.61) HTR7DRD2DRD3KCNH2SIGMAR1
SCHEMBL16633653 0.85 HTR7 (0.67) HTR7DRD2DRD3SIGMAR1
SCHEMBL15326136 0.82 DRD2 (0.55) HTR7DRD2DRD3KCNH2
SCHEMBL27940453 0.80 DRD2 (0.56) HTR7DRD2DRD3KCNH2
SCHEMBL15326107 0.79 HTR7 (0.52) HTR7DRD2DRD3KCNH2
SCHEMBL15326094 0.78 HTR7 (0.61) HTR7DRD2DRD3SIGMAR1
SCHEMBL27921837 0.78 HTR7 (0.54) HTR7DRD2DRD3KCNH2
SCHEMBL15326104 0.78 DRD2 (0.54) HTR7DRD2DRD3
SCHEMBL16633146 0.77 KCNH2 (0.58) HTR7DRD2DRD3KCNH2SIGMAR1
SCHEMBL16634075 0.77 KCNH2 (0.62) HTR7DRD2DRD3KCNH2SIGMAR1

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-9238632-B2 3-cyanoanilinoalkylarylpiperazine derivative and use thereof in preparing drugs NHWA Pharma, Corporation (CN) 2016-01-19 US claimed
US-20150105399-A1 3-CYANOANILINOALKYLARYLPIPERAZINE DERIVATIVE AND USE THEREOF IN PREPARING DRUGS SHANGHAI INSTITUTE OF PHARMACEUTICAL INDUSTRY (CN) 2015-04-16 US claimed
US-9238632-B2 3-cyanoanilinoalkylarylpiperazine derivative and use thereof in preparing drugs NHWA Pharma, Corporation (CN) 2016-01-19 US disclosed
US-9238632-B2 3-cyanoanilinoalkylarylpiperazine derivative and use thereof in preparing drugs NHWA Pharma, Corporation (CN) 2016-01-19 US disclosed
US-20150105399-A1 3-CYANOANILINOALKYLARYLPIPERAZINE DERIVATIVE AND USE THEREOF IN PREPARING DRUGS SHANGHAI INSTITUTE OF PHARMACEUTICAL INDUSTRY (CN) 2015-04-16 US disclosed
US-20150105399-A1 3-CYANOANILINOALKYLARYLPIPERAZINE DERIVATIVE AND USE THEREOF IN PREPARING DRUGS SHANGHAI INSTITUTE OF PHARMACEUTICAL INDUSTRY (CN) 2015-04-16 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-20150105399-A1 3-CYANOANILINOALKYLARYLPIPERAZINE DERIVATIVE AND USE THEREOF IN PREPARING DRUGS HTR5A, HTR3C, HTR3A HTR7 27/4885DRD2 80/4885DRD3 57/4885

“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.