SCHEMBL5744006

SCHEMBL5744006

CCOC(=O)C1CCN(Cc2ccc(Cl)c(Cl)c2)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 1.00
ALDH1A1 P00352 4/20 1.00
SMN1; SMN2 Q16637 3/20 1.00
KMT2A Q03164 2/20 0.67
MAPT P10636 1/20 0.64
TSHR P16473 2/20 0.63
CCR8 P51685 1/20 0.61
POLB P06746 1/20 0.61
ATM Q13315 1/20 0.59
GAA P10253 1/20 0.59
PKM P14618 1/20 0.59
HTT P42858 1/20 0.59
MEN1 O00255 1/20 0.59
HRH3 Q9Y5N1 1/20 0.58

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
SCHEMBL6093231 0.87 KDM4E (0.77) KDM4EALDH1A1SMN1; SMN2KMT2AMAPT
SCHEMBL1888780 0.84 KDM4E (0.74) KDM4EALDH1A1SMN1; SMN2KMT2AMAPT
SCHEMBL22265730 0.84 KDM4E (0.76) KDM4EALDH1A1SMN1; SMN2KMT2AMAPT
SCHEMBL1505913 0.83 ALDH1A1 (0.75) KDM4EALDH1A1SMN1; SMN2KMT2AMAPT
SCHEMBL3156422 0.83 KDM4E (0.73) KDM4EALDH1A1SMN1; SMN2KMT2AMAPT
SCHEMBL608528 0.83 ALDH1A1 (0.76) KDM4EALDH1A1SMN1; SMN2KMT2AMAPT
SCHEMBL6988354 0.82 KDM4E (0.74) KDM4EALDH1A1SMN1; SMN2KMT2AMAPT
Hydrochloric Acid SCHEMBL7438287 0.82 ALDH1A1 (0.74) KDM4EALDH1A1SMN1; SMN2KMT2AMAPT
SCHEMBL16309015 0.81 KDM4E (0.69) KDM4EALDH1A1SMN1; SMN2KMT2AMAPT
SCHEMBL7302723 0.81 CCR8 (0.70) KDM4EALDH1A1SMN1; SMN2KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6984637-B2 Cyclic amine derivatives-CCR-3 receptor antagonists SYNTEX (U.S.A.) LLC (US) 2006-01-10 US disclosed
EP-0903349-B1 CCR-3 receptor antagonists HOFFMANN LA ROCHE (CH) 2006-01-04 EP disclosed
US-20040266782-A1 Cyclic amine derivatives-CCR-3 receptor antagonists GONG LEYI (US) 2004-12-30 US disclosed
US-6770650-B2 CHEMOKINE RECEPTOR (CCR) ANTAGONISTS SUCH AS N-(1(S)-(4-(3,4-DICHLOROBENZYL)PIPERAZIN-1-YLMETHYL)-2-METHYLPROPYL)-4 -METHYLBENZAMIDE DIHYDROCHLORIDE SALT FOR TREATMENT OF ASTHMA SYNTEX (U.S.A.) LLC 2004-08-03 US disclosed
US-6683074-B1 PYRROLIDINYL, PIPERAZINYL AND AZEPINYL DERIVATIVES; INFLAMMATORY OR ALLERGIC DISEASES SYNTEX (U.S.A.) LLC 2004-01-27 US disclosed
US-20030153577-A1 Cyclic amine derivatives-CCR-3 receptor antagonists ROCHE BIOSCIENCE 2003-08-14 US disclosed
US-6339087-B1 FOR THERAPY OF INFLAMMATORY OR ALLERGIC DISEASES ARE SELECTED FROM ASTHMA, ALLERGIC RHINITIS, HYPERSENSITIVITY LUNG DISEASES, HYPERSENSITIVITY PNEUMONITIS, EOSINOPHILIC PNEUMONIAS, INFLAMMATORY BOWEL DISEASES, PSORIASIS, DERMATITIS SYNTEX (U.S.A.) LLC 2002-01-15 US disclosed
US-6323223-B1 CCR-3 RECEPTOR ANTAGONISTS, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, METHODS FOR THEIR USE AND METHODS FOR PREPARING THESE COMPOUNDS. SYNTEX (U.S.A.) LLC 2001-11-27 US disclosed
EP-0903349-A2 CCR-3 receptor antagonists F. HOFFMANN-LA ROCHE AG (CH) 1999-03-24 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 (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-20040266782-A1 Cyclic amine derivatives-CCR-3 receptor antagonists CCR3, CCR1, CCRL2 KDM4E 3302/4885ALDH1A1 1098/4885SMN1; SMN2 3154/4885
US-20030153577-A1 Cyclic amine derivatives-CCR-3 receptor antagonists CCR3, CCR1, CCRL2 KDM4E 3302/4885ALDH1A1 1098/4885SMN1; SMN2 3154/4885

“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.