SCHEMBL6990725

SCHEMBL6990725

c1ccc(CN2CCC(CCc3nccc4ccccc34)CC2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ACHE P22303 16/20 1.00
DRD2 P14416 3/20 0.52
DRD4 P21917 3/20 0.52
DRD3 P35462 3/20 0.52
HRH3 Q9Y5N1 1/20 0.51
BCHE P06276 2/20 0.51

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
Fumaric Acid SCHEMBL6986264 0.92 ACHE (0.84) ACHEDRD2DRD4DRD3BCHE
Maleic Acid SCHEMBL6986260 0.92 ACHE (0.84) ACHEDRD2DRD4DRD3BCHE
SCHEMBL27338107 0.89 ACHE (0.80) ACHEHRH3
SCHEMBL9269917 0.81 ACHE (1.00) ACHEHRH3BCHE
SCHEMBL1581512 0.81 ACHE (0.67) ACHEDRD2DRD4DRD3
SCHEMBL24404498 0.77 CCR3 (0.69) ACHEDRD2HRH3BCHE
SCHEMBL1581866 0.77 ACHE (0.62) ACHEHRH3
SCHEMBL6989630 0.76 ACHE (0.64) ACHEHRH3BCHE
SCHEMBL6985471 0.76 ACHE (1.00) ACHEBCHE
SCHEMBL222028 0.76 ACHE (1.00) ACHEHRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0646115-B1 HETEROCYCLIC-CYCLIC AMINE DERIVATIVES EISAI CO LTD (JP) 2003-01-22 EP claimed
CN-1044242-C Heterocyclic-cyclic amine derivatives PFIZER (US) 1999-07-21 CN claimed
JP-2659107-B2 EISAI CO LTD (JP) 1997-09-30 JP claimed
EP-0646115-A1 HETEROCYCLIC-CYCLIC AMINE DERIVATIVES Eisai Co., Ltd. (JP) 1995-04-05 EP claimed
WO-1992017475-A1 HETEROCYCLIC-CYCLIC AMINE DERIVATIVES PFIZER INC. (US) 1992-10-15 WO claimed
CN-1065267-A HETEROCYCLIC-CYCLIC AMINE DERIVATIVES PFIZER (US) 1992-10-14 CN claimed
US-6498255-B2 CHOLINESTERASE INHIBITORS; COGNITION ACTIVATORS; ALZHEIMER'S DISEASE; E.G., 3-(2-(1-(PHENYLMETHYL)-4-PIPERIDINYL)ETHYL)-1,2-BENZISOXAZOLE PFIZER INC. 2002-12-24 US disclosed
US-20020028834-A1 Heterocyclic-cyclic amine derivatives VILLALOBOS ANABELLA (US) 2002-03-07 US disclosed
US-6326382-B1 CHOLINESTERASE INHIBITORS; USEFUL IN ENHANCING MEMORY IN PATIENTS SUFFERING FROM DEMENTIA AND ALZHEIMER'S DISEASE EISAI CO., LTD (JP) 2001-12-04 US disclosed
CN-1044242-C Heterocyclic-cyclic amine derivatives PFIZER (US) 1999-07-21 CN disclosed
US-5538984-A Methods of using piperidyl-benzisoxazole and benisothiazole derivatives as cholinesterase inhibitors PFIZER INC. (US) 1996-07-23 US disclosed
EP-0646115-A1 HETEROCYCLIC-CYCLIC AMINE DERIVATIVES Eisai Co., Ltd. (JP) 1995-04-05 EP disclosed
WO-1992017475-A1 HETEROCYCLIC-CYCLIC AMINE DERIVATIVES PFIZER INC. (US) 1992-10-15 WO disclosed
CN-1065267-A HETEROCYCLIC-CYCLIC AMINE DERIVATIVES PFIZER (US) 1992-10-14 CN 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-20020028834-A1 Heterocyclic-cyclic amine derivatives BCHE, ACHE, CHRM1 ACHE 2/4885DRD2 294/4885DRD4 700/4885

“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.