SCHEMBL2307434

SCHEMBL2307434

Cc1noc2cc3c(cc12)CCNCC3

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CHRNB2 P17787 2/20 0.53
▸ CHRNA4 P43681 2/20 0.53
▸ ADCY6 O43306 1/20 0.38
▸ ADCY3 O60266 1/20 0.38
▸ ADCY9 O60503 1/20 0.38
▸ ADCY5 O95622 1/20 0.38
▸ ADCY8 P40145 1/20 0.38
▸ ADCY7 P51828 1/20 0.38
▸ ADCY2 Q08462 1/20 0.38
▸ ADCY1 Q08828 1/20 0.38
▸ ADCY4 Q8NFM4 1/20 0.38
▸ DRD3 P35462 3/20 0.38
▸ KCNH2 Q12809 3/20 0.38
▸ BRD4 O60885 6/20 0.37
▸ HRH1 P35367 2/20 0.35
▸ HTR2C P28335 4/20 0.34
▸ HTR2B P41595 4/20 0.34
▸ HTR2A P28223 3/20 0.34
▸ HTR7 P34969 2/20 0.33
▸ HTR1D P28221 1/20 0.33

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
SCHEMBL24754073 0.84 CHRNB2 (0.49) CHRNB2CHRNA4DRD3KCNH2BRD4
SCHEMBL2315754 0.79 HRH1 (0.38) CHRNB2CHRNA4ADCY6ADCY3ADCY9
SCHEMBL3446143 0.71 CHRNB2 (0.72) CHRNB2CHRNA4BRD4HTR2CPPARD
SCHEMBL6988890 0.69 BRD4 (0.53) CHRNB2CHRNA4BRD4
SCHEMBL2314077 0.68 DRD3 (0.44) CHRNB2CHRNA4DRD3KCNH2HRH1
SCHEMBL24302859 0.68 BRD4 (0.39) CHRNB2CHRNA4DRD3KCNH2BRD4
SCHEMBL6849395 0.68 OPRL1 (0.42) CHRNB2CHRNA4
SCHEMBL8257626 0.68 OPRL1 (0.42) CHRNB2CHRNA4BRD4
SCHEMBL6989976 0.68 BCHE (0.44) CHRNB2CHRNA4BRD4
SCHEMBL28502051 0.68 ADRB1 (0.53) CHRNB2CHRNA4HTR3AHTR5AHTR6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1751163-B1 BENZAZEPINE COMPOUNDS HAVING AFFINITY FOR DOPAMINE D3 RECEPTOR AND USES THEREOF GLAXO GROUP LTD (GB) 2011-08-10 — — EP disclosed
US-7989444-B2 Compounds having affinity for dopamine D3 receptor and uses thereof GLAXO GROUP LIMITED (GB) 2011-08-02 — — US disclosed
US-7989444-B2 Compounds having affinity for dopamine D3 receptor and uses thereof GLAXO GROUP LIMITED (GB) 2011-08-02 — — US disclosed
US-7989444-B2 Compounds having affinity for dopamine D3 receptor and uses thereof GLAXO GROUP LIMITED (GB) 2011-08-02 — — US disclosed
US-20100016287-A1 COMPOUNDS HAVING AFFINITY FOR DOPAMINE D3 RECEPTOR AND USES THEREOF\ GLAXO GROUP LIMITED (GB) 2010-01-21 — — US disclosed
US-20100016287-A1 COMPOUNDS HAVING AFFINITY FOR DOPAMINE D3 RECEPTOR AND USES THEREOF\ GLAXO GROUP LIMITED (GB) 2010-01-21 — — US disclosed
US-20100016287-A1 COMPOUNDS HAVING AFFINITY FOR DOPAMINE D3 RECEPTOR AND USES THEREOF\ GLAXO GROUP LIMITED (GB) 2010-01-21 — — 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-20100016287-A1 COMPOUNDS HAVING AFFINITY FOR DOPAMINE D3 RECEPTOR AND USES THEREOF\ DRD3, DRD2, SLC6A3 CHRNB2 190/4885CHRNA4 116/4885ADCY6 920/4885

“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.

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