SCHEMBL6306261

SCHEMBL6306261

N#Cc1ccccc1Oc1ccc(C(=O)NC2CC3CC2CN3)cc1

nearest known ligand 0.58

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EZH2 Q15910 12/20 0.58
MAPK14 Q16539 4/20 0.54
CYP3A4 P08684 1/20 0.51
KCNH2 Q12809 1/20 0.46
LPAR1 Q92633 1/20 0.44
LPAR5 Q9H1C0 1/20 0.44
PTGDR2 Q9Y5Y4 1/20 0.43
POLB P06746 1/20 0.41
GAA P10253 1/20 0.41

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
SCHEMBL6310028 0.85 EPHX2 (0.51) EZH2POLB
SCHEMBL6303876 0.84 EZH2 (0.42) EZH2MAPK14GAA
SCHEMBL6303213 0.84 EZH2 (0.56) EZH2MAPK14LPAR1LPAR5
SCHEMBL6303416 0.84 EZH2 (0.57) EZH2LPAR1LPAR5GAA
SCHEMBL6306678 0.84 PARP10 (0.48) EZH2LPAR1LPAR5
SCHEMBL6311929 0.83 MMP2 (0.55) EZH2MAPK14CYP3A4
SCHEMBL7127436 0.82 EZH2 (0.57) EZH2MAPK14CYP3A4KCNH2LPAR1
SCHEMBL6305845 0.82 EZH2 (0.57) EZH2MAPK14CYP3A4KCNH2LPAR1
SCHEMBL6306538 0.82 EZH2 (0.43) EZH2
SCHEMBL6306761 0.82 CTNNB1 (0.47) EZH2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1480977-A2 SUBSTITUTED ARYL COMPOUNDS FOR TREATMENT OF DISEASE PHARMACIA & UPJOHN COMPANY (US) 2004-12-01 EP claimed
US-20030236279-A1 Substituted-aryl compounds for treatment of disease PHARMACIA & UPJOHN COMPANY 2003-12-25 US claimed
WO-2003070728-A2 AZABICYCLO-SUBSTITUTED BENZOYLAMIDES AND THIOAMIDES FOR TREATMENT OF CNS-RELATED DISORDERS PHARMACIA & UPJOHN COMPANY (US) 2003-08-28 WO claimed
US-6852716-B2 Substituted-aryl compounds for treatment of disease PFIZER INC (US) 2005-02-08 US disclosed
EP-1480977-A2 SUBSTITUTED ARYL COMPOUNDS FOR TREATMENT OF DISEASE PHARMACIA & UPJOHN COMPANY (US) 2004-12-01 EP disclosed
US-20030236279-A1 Substituted-aryl compounds for treatment of disease PHARMACIA & UPJOHN COMPANY 2003-12-25 US disclosed
WO-2003070728-A2 AZABICYCLO-SUBSTITUTED BENZOYLAMIDES AND THIOAMIDES FOR TREATMENT OF CNS-RELATED DISORDERS PHARMACIA & UPJOHN COMPANY (US) 2003-08-28 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 (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-20030236279-A1 Substituted-aryl compounds for treatment of disease NAT1, CYP7A1, CYP7B1 EZH2 4701/4885MAPK14 2726/4885CYP3A4 157/4885

“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.