SCHEMBL4499983

SCHEMBL4499983

O=C(CCCN1CCC(Cc2ccccc2)CC1)c1ccc(Br)cc1

nearest known ligand 0.82

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYP2J2 P51589 1/20 0.65
SLC6A2 P23975 3/20 0.62
SLC6A4 P31645 3/20 0.62
CCR3 P51677 1/20 0.57

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
SCHEMBL9050713 0.91 CCR3 (0.66) CCR3
Hydrochloric Acid SCHEMBL9053162 0.90 CCR3 (0.65) CCR3
SCHEMBL4512783 0.88 DRD2 (0.71) CCR3
Hydrochloric Acid SCHEMBL7303580 0.87 DRD2 (0.69) CCR3
SCHEMBL17023763 0.85 CYP2J2 (0.70) CYP2J2SLC6A2SLC6A4CCR3
SCHEMBL11678538 0.83 KDM4E (0.59) SLC6A2SLC6A4CCR3
SCHEMBL7012490 0.82 CCR3 (0.67) SLC6A2SLC6A4CCR3
SCHEMBL11548949 0.82 GRIN2B (0.55) SLC6A2SLC6A4CCR3
SCHEMBL11679317 0.82 GRIN2B (0.55) SLC6A2SLC6A4CCR3
SCHEMBL7532115 0.81 GRIN2B (0.62)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7485651-B2 Compounds with activity on muscarinic receptors ACADIA PHARMACEUTICALS, INC. (US) 2009-02-03 US disclosed
US-20080108618-A1 COMPOUNDS WITH ACTIVITY ON MUSCARINIC RECEPTORS BRANN MARK 2008-05-08 US disclosed
US-20030144285-A1 Compounds with activity on muscarinic receptors BRANN MARK (US) 2003-07-31 US disclosed
US-6528529-B1 4-Methoxy-1-(4-(2-methylphenyl)-4-oxo-1-butyl)piperidine ACADIA PHARMACEUTICALS INC. 2003-03-04 US disclosed
CN-1303376-A Compound with activity on muscarinic receptors ACADIA PHARMACEUTICAL INC (US) 2001-07-11 CN disclosed
WO-2001005763-A2 COMPOUNDS WITH ACTIVITY ON MUSCARINIC RECEPTORS ACADIA PHARMACEUTICALS, INC. (US) 2001-01-25 WO disclosed
EP-1068185-A1 COMPOUNDS WITH ACTIVITY ON MUSCARINIC RECEPTORS Acadia Pharmaceuticals Inc. (US) 2001-01-17 EP disclosed
WO-1999050247-A1 COMPOUNDS WITH ACTIVITY ON MUSCARINIC RECEPTORS ACADIA PHARMACEUTICALS, INC. (US) 1999-10-07 WO 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 (2 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-20080108618-A1 COMPOUNDS WITH ACTIVITY ON MUSCARINIC RECEPTORS CHRM3, CHRM2, CHRM1 CYP2J2 1975/4885SLC6A2 998/4885SLC6A4 1516/4885
US-20030144285-A1 Compounds with activity on muscarinic receptors CHRM3, CHRM2, CHRM1 CYP2J2 1975/4885SLC6A2 998/4885SLC6A4 1516/4885

“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.