SCHEMBL1703578

SCHEMBL1703578

CCOC(=O)c1nn(-c2ccc(Cl)cc2Cl)c2c1CCc1sc(Cl)cc1-2

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.50
▸ MEN1 O00255 1/20 0.50
▸ MAPT P10636 1/20 0.50
▸ MAPK1 P28482 1/20 0.50
▸ KMT2A Q03164 1/20 0.50
▸ CNR1 P21554 4/20 0.47
▸ SLC5A1 P13866 1/20 0.46
▸ SLC5A2 P31639 1/20 0.46
▸ CNR2 P34972 4/20 0.44
▸ GABRA2 P47869 1/20 0.43
▸ GABRB2 P47870 1/20 0.43

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
SCHEMBL2773467 0.93 KDM4E (0.50) KDM4EMEN1MAPTMAPK1KMT2A
SCHEMBL2774189 0.91 KDM4E (0.49) KDM4EMEN1MAPTMAPK1KMT2A
SCHEMBL2777190 0.85 ALDH1A1 (0.44) KDM4EMEN1MAPTKMT2ACNR1
SCHEMBL496088 0.85 CNR2 (0.49) CNR1CNR2
SCHEMBL495958 0.81 CNR2 (0.61) CNR1CNR2
SCHEMBL2911118 0.81 CNR2 (0.66) CNR1CNR2
SCHEMBL2906584 0.81 CNR2 (0.57) CNR1CNR2
SCHEMBL7295117 0.80 CNR2 (0.42) CNR1CNR2
SCHEMBL496033 0.79 CNR2 (0.48) CNR1CNR2
SCHEMBL496092 0.79 CNR2 (0.53) CNR1CNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120088751-A1 PHARMACEUTICAL COMPOUNDS NEUROSCIENCZE PHARMANESS S.C. A R.L. (IT) 2012-04-12 — — US disclosed
US-20120088751-A1 PHARMACEUTICAL COMPOUNDS NEUROSCIENCZE PHARMANESS S.C. A R.L. (IT) 2012-04-12 — — US disclosed
US-8106218-B2 Pharmaceutical compounds NEUROSCIENZE PHARMANESS S.C. A R.L. (IT) 2012-01-31 — — US disclosed
US-8106218-B2 Pharmaceutical compounds NEUROSCIENZE PHARMANESS S.C. A R.L. (IT) 2012-01-31 — — US disclosed
EP-1602658-B1 Tricyclic pyrazole derivatives as cannabinoid receptor antagonists NEUROSCIENZE PHARMANESS S C A R L (IT) 2011-12-07 — — EP disclosed
US-20090081123-A1 PHARMACEUTICAL COMPOUNDS CENERX BIOPHARMA (US) 2009-03-26 — — US disclosed
US-20090081123-A1 PHARMACEUTICAL COMPOUNDS CENERX BIOPHARMA (US) 2009-03-26 — — US disclosed
US-7485730-B2 Pharmaceutical compounds NEUROSCIENZE PHARMANESS S.C. A R.L. (IT) 2009-02-03 — — US disclosed
US-7485730-B2 Pharmaceutical compounds NEUROSCIENZE PHARMANESS S.C. A R.L. (IT) 2009-02-03 — — US disclosed
EP-1602658-A1 Tricyclic pyrazole derivatives as cannabinoid receptor antagonists Neuroscienze Oharmaness S.c.a.r.l. (IT) 2005-12-07 — — 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-20120088751-A1 PHARMACEUTICAL COMPOUNDS CNR2, CNR1, OPRK1 KDM4E 581/4885MEN1 4563/4885MAPT 2961/4885
US-20090081123-A1 PHARMACEUTICAL COMPOUNDS CNR2, CNR1, OPRK1 KDM4E 582/4885MEN1 4591/4885MAPT 2960/4885

“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.

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