SCHEMBL7627376

SCHEMBL7627376

CC(=O)NCC1(C2CCN(Cc3ccccc3)CC2)CCCCC1

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ DRD4 P21917 1/20 0.52
▸ CACNA1G O43497 5/20 0.51
▸ DPP7 Q9UHL4 1/20 0.48
▸ CYP2D6 P10635 1/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ TSHR P16473 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ SIGMAR1 Q99720 1/20 0.46

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
SCHEMBL6605017 0.91 DRD4 (0.54) DRD4CACNA1GDPP7MEN1TSHR
SCHEMBL7625330 0.77 ACHE (0.50) DRD4CACNA1GMEN1TSHRKMT2A
SCHEMBL6603960 0.77 KDM4E (0.50) CACNA1GSIGMAR1
SCHEMBL7631442 0.77 NPFFR1 (0.52) CYP2D6SIGMAR1
SCHEMBL2988825 0.75 MEN1 (0.55) DRD4CACNA1GDPP7MEN1TSHR
SCHEMBL17469031 0.75 ACHE (0.70) DRD4
SCHEMBL9182416 0.75 OPRM1 (0.43) DRD4CYP2D6SIGMAR1
SCHEMBL16795160 0.74 DRD4 (0.54) DRD4CACNA1GDPP7MEN1TSHR
SCHEMBL3937184 0.74 NPFFR1 (0.66) DRD4CACNA1GCYP2D6MEN1KMT2A
SCHEMBL23070812 0.74 NPFFR1 (0.60) MEN1KMT2ASIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6444677-B2 TREATMENT OF INFLAMMATION, CARDIOVASCULAR DISEASE, PAIN, ETC. PFIZER INC. 2002-09-03 — — US disclosed
US-20010046993-A1 5-memberd heteroaryl substituted 1,4-dihydropyridine compounds as bradykinin antagonists IKEDA TAKAFUMI (JP) 2001-11-29 — — US disclosed
EP-1106614-A1 5-Membered heteroaryl substituted 1,4-dihydropyridine compounds as bradykinin antagonists PFIZER INC. (US) 2001-06-13 — — EP 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-20010046993-A1 5-memberd heteroaryl substituted 1,4-dihydropyridine compounds as bradykinin antagonists BDKRB1, BDKRB2, CNR2 DRD4 998/4885CACNA1G 291/4885DPP7 916/4885

“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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