SCHEMBL2367022

SCHEMBL2367022

CN1CCCc2c1c1ccc(CN3CCOCC3)cc1[nH]c2=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 20/20 1.00
PARP2 Q9UGN5 3/20 0.50
KCNH2 Q12809 2/20 0.50
TNK1 Q13470 2/20 0.48
TNK2 Q07912 1/20 0.48

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
Hydrochloric Acid SCHEMBL2366261 0.99 PARP1 (0.98) PARP1PARP2KCNH2TNK1TNK2
SCHEMBL2385716 0.91 PARP1 (0.84) PARP1PARP2KCNH2TNK1TNK2
Hydrochloric Acid SCHEMBL2380617 0.90 PARP1 (0.82) PARP1PARP2KCNH2TNK1TNK2
SCHEMBL2366944 0.90 PARP1 (0.82) PARP1PARP2KCNH2TNK1TNK2
Hydrochloric Acid SCHEMBL2366988 0.89 PARP1 (0.80) PARP1PARP2KCNH2TNK1TNK2
Hydrochloric Acid SCHEMBL6405673 0.84 PARP1 (0.74) PARP1PARP2KCNH2TNK1TNK2
SCHEMBL2366943 0.80 PARP1 (1.00) PARP1
SCHEMBL2366214 0.80 PARP1 (1.00) PARP1TNK1TNK2
Hydrochloric Acid SCHEMBL2366803 0.79 PARP1 (0.98) PARP1
Hydrochloric Acid SCHEMBL2366657 0.79 PARP1 (0.98) PARP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8815891-B2 Tricyclic derivative or pharmaceutically acceptable salts thereof, preparation method thereof, and pharmaceutical composition containing the same JE IL PHARMACEUTICAL CO., LTD. (KR) 2014-08-26 US claimed
EP-2364983-B1 NOVEL TRICYCLIC DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF, PREPARATION METHOD THEREOF, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME JEIL PHARMACEUTICAL CO LTD (KR) 2013-10-23 EP claimed
EP-2364983-A2 NOVEL TRICYCLIC DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF, PREPARATION METHOD THEREOF, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME Jeil Pharmaceutical Co., Ltd. (KR) 2011-09-14 EP claimed
US-20110218193-A1 NOVEL TRICYCLIC DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF, PREPARATION METHOD THEREOF, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME JE IL PHARMACEUTICAL CO., LTD. (KR) 2011-09-08 US claimed
US-8815891-B2 Tricyclic derivative or pharmaceutically acceptable salts thereof, preparation method thereof, and pharmaceutical composition containing the same JE IL PHARMACEUTICAL CO., LTD. (KR) 2014-08-26 US disclosed
US-8815891-B2 Tricyclic derivative or pharmaceutically acceptable salts thereof, preparation method thereof, and pharmaceutical composition containing the same JE IL PHARMACEUTICAL CO., LTD. (KR) 2014-08-26 US disclosed
US-8815891-B2 Tricyclic derivative or pharmaceutically acceptable salts thereof, preparation method thereof, and pharmaceutical composition containing the same JE IL PHARMACEUTICAL CO., LTD. (KR) 2014-08-26 US disclosed
EP-2364983-B1 NOVEL TRICYCLIC DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF, PREPARATION METHOD THEREOF, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME JEIL PHARMACEUTICAL CO LTD (KR) 2013-10-23 EP disclosed
EP-2364983-B1 NOVEL TRICYCLIC DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF, PREPARATION METHOD THEREOF, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME JEIL PHARMACEUTICAL CO LTD (KR) 2013-10-23 EP disclosed
EP-2364983-A2 NOVEL TRICYCLIC DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF, PREPARATION METHOD THEREOF, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME Jeil Pharmaceutical Co., Ltd. (KR) 2011-09-14 EP disclosed
EP-2364983-A2 NOVEL TRICYCLIC DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF, PREPARATION METHOD THEREOF, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME Jeil Pharmaceutical Co., Ltd. (KR) 2011-09-14 EP disclosed
US-20110218193-A1 NOVEL TRICYCLIC DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF, PREPARATION METHOD THEREOF, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME JE IL PHARMACEUTICAL CO., LTD. (KR) 2011-09-08 US disclosed
US-20110218193-A1 NOVEL TRICYCLIC DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF, PREPARATION METHOD THEREOF, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME JE IL PHARMACEUTICAL CO., LTD. (KR) 2011-09-08 US disclosed
US-20110218193-A1 NOVEL TRICYCLIC DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF, PREPARATION METHOD THEREOF, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME JE IL PHARMACEUTICAL CO., LTD. (KR) 2011-09-08 US 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-20110218193-A1 NOVEL TRICYCLIC DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF, PREPARATION METHOD THEREOF, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME PARP1, PARP15, PARP11 PARP1 1/4885PARP2 4/4885KCNH2 3365/4885

“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.