SCHEMBL2402832

SCHEMBL2402832

COc1ccc(-c2c(C)nn3c(Nc4ccccc4)c4c(nc23)CCC4)c(C)c1

nearest known ligand 0.75

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.75
MAPT P10636 4/20 0.75
ALDH1A1 P00352 3/20 0.75
MAPK1 P28482 3/20 0.75
KDM4E B2RXH2 3/20 0.74
LMNA P02545 1/20 0.74
L3MBTL1 Q9Y468 1/20 0.74
CRHR1 P34998 14/20 0.70
NPSR1 Q6W5P4 1/20 0.52

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
SCHEMBL2402540 0.93 CRHR1 (0.70) HPGDMAPTALDH1A1MAPK1KDM4E
SCHEMBL2405237 0.92 HPGD (0.70) HPGDMAPTALDH1A1MAPK1KDM4E
SCHEMBL2401635 0.91 CRHR1 (0.70) HPGDMAPTALDH1A1MAPK1KDM4E
SCHEMBL13139625 0.85 CRHR1 (0.78) HPGDMAPTALDH1A1MAPK1CRHR1
SCHEMBL2402742 0.85 CRHR1 (0.72) HPGDMAPTALDH1A1MAPK1KDM4E
SCHEMBL2402513 0.84 CRHR1 (0.80) MAPTKDM4ECRHR1NPSR1
SCHEMBL2402679 0.83 CRHR1 (0.78) MAPTALDH1A1KDM4ECRHR1NPSR1
Hydrochloric Acid SCHEMBL2402285 0.83 CRHR1 (0.78) MAPTKDM4ECRHR1NPSR1
SCHEMBL2402661 0.83 CRHR1 (0.70) HPGDMAPTALDH1A1MAPK1KDM4E
SCHEMBL2402672 0.83 CRHR1 (0.70) HPGDMAPTALDH1A1MAPK1KDM4E

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 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1832590-B1 Heterotricyclic compounds as CRF receptor antagonists ONO PHARMACEUTICAL CO (JP) 2011-09-28 EP claimed
US-20090137604-A1 TRI-HETEROCYCLIC COMPOUNDS AND A PHARMACEUTICAL COMPRISING THEM AS AN ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2009-05-28 US claimed
US-7459459-B2 Tri-heterocyclic compounds and a pharmaceutical comprising them as an active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2008-12-02 US claimed
EP-1832590-A2 Tri- heterocyclic compounds and a pharmaceutical comprising them as an active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2007-09-12 EP claimed
US-20060122392-A1 Tri-heterocyclic compounds and a pharmaceutical comprising them as an active ingredient ONO PHARMACEUTICAL CO., LTD. 2006-06-08 US claimed
US-20040072833-A1 Tricyclic and heterocyclic derivative compounds and drugs containing these compounds as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2004-04-15 US claimed
EP-1354884-A1 TRICYCLIC AND HETEROCYCLIC DERIVATIVE COMPOUNDS AND DRUGS CONTAINING THESE COMPOUNDS AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2003-10-22 EP claimed
EP-1832590-B1 Heterotricyclic compounds as CRF receptor antagonists ONO PHARMACEUTICAL CO (JP) 2011-09-28 EP disclosed
US-7807688-B2 Tri-heterocyclic compounds and a pharmaceutical comprising them as an active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2010-10-05 US disclosed
US-7807688-B2 Tri-heterocyclic compounds and a pharmaceutical comprising them as an active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2010-10-05 US disclosed
US-7807688-B2 Tri-heterocyclic compounds and a pharmaceutical comprising them as an active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2010-10-05 US disclosed
US-20090137604-A1 TRI-HETEROCYCLIC COMPOUNDS AND A PHARMACEUTICAL COMPRISING THEM AS AN ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2009-05-28 US disclosed
US-20090137604-A1 TRI-HETEROCYCLIC COMPOUNDS AND A PHARMACEUTICAL COMPRISING THEM AS AN ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2009-05-28 US disclosed
US-7459459-B2 Tri-heterocyclic compounds and a pharmaceutical comprising them as an active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2008-12-02 US disclosed
US-7459459-B2 Tri-heterocyclic compounds and a pharmaceutical comprising them as an active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2008-12-02 US disclosed
EP-1832590-A2 Tri- heterocyclic compounds and a pharmaceutical comprising them as an active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2007-09-12 EP disclosed
US-20060122392-A1 Tri-heterocyclic compounds and a pharmaceutical comprising them as an active ingredient ONO PHARMACEUTICAL CO., LTD. 2006-06-08 US disclosed
US-7034153-B2 Tricyclic and heterocyclic derivative compounds and drugs containing these compounds as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2006-04-25 US disclosed
US-20040072833-A1 Tricyclic and heterocyclic derivative compounds and drugs containing these compounds as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2004-04-15 US disclosed
EP-1354884-A1 TRICYCLIC AND HETEROCYCLIC DERIVATIVE COMPOUNDS AND DRUGS CONTAINING THESE COMPOUNDS AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2003-10-22 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 (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-20060122392-A1 Tri-heterocyclic compounds and a pharmaceutical comprising them as an active ingredient NR3C1, CRHR2, CRHR1 HPGD 1348/4885MAPT 2264/4885ALDH1A1 3364/4885
US-20090137604-A1 TRI-HETEROCYCLIC COMPOUNDS AND A PHARMACEUTICAL COMPRISING THEM AS AN ACTIVE INGREDIENT NR3C1, CRHR2, CRHR1 HPGD 1348/4885MAPT 2264/4885ALDH1A1 3364/4885
US-20040072833-A1 Tricyclic and heterocyclic derivative compounds and drugs containing these compounds as the active ingredient CRH, CRHR1, CRHR2 HPGD 738/4885MAPT 1386/4885ALDH1A1 2512/4885

“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.