SCHEMBL6906326

SCHEMBL6906326

COc1ccc(CN2CCN(c3cccc(C)c3Cl)CC2)c(OC)c1

nearest known ligand 0.67

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 10/20 0.67
TSHR P16473 3/20 0.67
LMNA P02545 2/20 0.67
MAPK1 P28482 1/20 0.60
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
MAPT P10636 2/20 0.53
TDP1 Q9NUW8 2/20 0.52
HTT P42858 1/20 0.52
ALDH1A1 P00352 3/20 0.52
HTR7 P34969 4/20 0.52
ALOX15 P16050 1/20 0.50
GAA P10253 2/20 0.49

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
SCHEMBL6908658 0.91 KDM4E (0.71) KDM4ETSHRLMNAMAPTTDP1
SCHEMBL4753124 0.83 KDM4E (0.81) KDM4ETSHRLMNAMAPK1KMT2A
SCHEMBL6903347 0.81 KDM4E (0.73) KDM4ETSHRLMNAMAPK1MEN1
SCHEMBL6902190 0.79 LMNA (0.64) KDM4ETSHRLMNAMAPK1MEN1
SCHEMBL6906347 0.79 ALDH1A1 (0.78) KDM4ETSHRLMNAMAPK1KMT2A
SCHEMBL2316528 0.76 KDM4E (0.77) KDM4ETSHRLMNAMAPK1MEN1
SCHEMBL9831262 0.74 KDM4E (0.64) KDM4ETSHRLMNAMAPK1MEN1
SCHEMBL28191688 0.73 KDM4E (0.63) KDM4ETSHRLMNAMAPK1MEN1
SCHEMBL13727749 0.72 KDM4E (0.68) KDM4ETSHRLMNAMAPK1MEN1
SCHEMBL27921070 0.72 KDM4E (0.62) KDM4ETSHRLMNAMAPK1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020052373-A1 Combination treatment for dementia or cognitive deficits associated with alzheimer's disease and parkinson's disease ZORN STEVIN H (US) 2002-05-02 US claimed
EP-1201268-A2 Combinations of D4 dopamine receptor antagonists with acetylcholine esterase inhibitors Pfizer Products Inc. (US) 2002-05-02 EP claimed
US-6121267-A ADMINISTERING DOPAMINE ANTAGONIST TO TREAT PSYCHOLOGICAL DISORDER, I.E., SCHIZOPHRENIA WARNER-LAMBERT COMPANY (US) 2000-09-19 US claimed
WO-1997041108-A1 SUBSTITUTED PIPERAZINES AND PIPERIDINES AS CENTRAL NERVOUS SYSTEM AGENTS WARNER-LAMBERT COMPANY (US) 1997-11-06 WO claimed
US-20040048869-A1 Combination treatment for depression, anxiety and psychosis PFIZER INC 2004-03-11 US disclosed
US-20020094986-A1 Combination treatment for depression, anxiety and psychosis PFIZER INC 2002-07-18 US disclosed
EP-1213031-A2 Combination treatment for depression, anxiety and psychosis comprising an antidepressant and/or anxiolytic and a D4 receptor antagonist Pfizer Products Inc. (US) 2002-06-12 EP disclosed
US-20020052373-A1 Combination treatment for dementia or cognitive deficits associated with alzheimer's disease and parkinson's disease ZORN STEVIN H (US) 2002-05-02 US disclosed
EP-1201268-A2 Combinations of D4 dopamine receptor antagonists with acetylcholine esterase inhibitors Pfizer Products Inc. (US) 2002-05-02 EP disclosed
US-6121267-A ADMINISTERING DOPAMINE ANTAGONIST TO TREAT PSYCHOLOGICAL DISORDER, I.E., SCHIZOPHRENIA WARNER-LAMBERT COMPANY (US) 2000-09-19 US disclosed
US-5965560-A AS DOPAMINE ANTAGONISTS AND ANTIPSYCHOTIC AGENTS WARNER-LAMBERT COMPANY (US) 1999-10-12 US disclosed
WO-1997041108-A1 SUBSTITUTED PIPERAZINES AND PIPERIDINES AS CENTRAL NERVOUS SYSTEM AGENTS WARNER-LAMBERT COMPANY (US) 1997-11-06 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 (3 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-20020094986-A1 Combination treatment for depression, anxiety and psychosis HTR4, CHRNA4, GRM4 KDM4E 3111/4885TSHR 94/4885LMNA 1496/4885
US-20020052373-A1 Combination treatment for dementia or cognitive deficits associated with alzheimer's disease and parkinson's disease ACHE, BCHE, CHRM4 KDM4E 1815/4885TSHR 905/4885LMNA 4258/4885
US-20040048869-A1 Combination treatment for depression, anxiety and psychosis HTR4, CHRNA4, GRM4 KDM4E 3111/4885TSHR 94/4885LMNA 1496/4885

“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.