SCHEMBL15465375

SCHEMBL15465375

CCOC(=O)c1cc(O)ccc1Cl

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 6/20 0.70
CA2 P00918 6/20 0.70
CA12 O43570 5/20 0.70
CA9 Q16790 5/20 0.70
CA7 P43166 4/20 0.70
CA14 Q9ULX7 4/20 0.70
CYP4F2 P78329 1/20 0.65
CYP4A11 Q02928 1/20 0.65
KMT2A Q03164 1/20 0.53
ESR1 P03372 1/20 0.53
ESR2 Q92731 1/20 0.53
TSHR P16473 1/20 0.52
MIF P14174 1/20 0.51
PFKFB3 Q16875 1/20 0.51
MAOA P21397 1/20 0.51
MAOB P27338 1/20 0.51
ALDH1A1 P00352 1/20 0.50
ALOX5 P09917 1/20 0.49
BAZ2B Q9UIF8 1/20 0.49
BAZ2A Q9UIF9 1/20 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
SCHEMBL1496051 0.86 CA12 (0.70) CA1CA2CA12CA9CA7
SCHEMBL1179501 0.85 CYP4F2 (0.53) CA1CA2CA12CA9CA7
SCHEMBL2406530 0.84 CYP4F2 (0.67) CA1CA2CA12CA9CA7
SCHEMBL11225504 0.84 CYP4F2 (0.67) CYP4F2CYP4A11KMT2ATSHRALDH1A1
SCHEMBL10449048 0.84 CA12 (0.77) CA1CA2CA12CA9CA7
SCHEMBL320406 0.83 CYP4F2 (0.79) CA1CA2CA12CA9CA7
SCHEMBL550228 0.82 CA12 (0.74) CA1CA2CA12CA9CA7
SCHEMBL29457603 0.82 CA12 (1.00) CA1CA2CA12CA9CA7
SCHEMBL39259 0.82 CA12 (1.00) CA1CA2CA12CA9CA7
SCHEMBL194508 0.81 CYP4F2 (0.63) CA1CA2CA12CA9CA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240190824-A1 INHIBITORS OF TREK (TWIK RELATED K+ CHANNELS) CHANNEL FUNCTION ONO PHARMACEUTICAL CO., LTD. (JP) 2024-06-13 US disclosed
EP-4048399-A1 INHIBITORS OF TREK (TWIK RELATED K+ CHANNELS) CHANNEL FUNCTION ONO Pharmaceutical Co., Ltd. (JP) 2022-08-31 EP disclosed
WO-2021080013-A1 INHIBITORS OF TREK (TWIK RELATED K+ CHANNELS) CHANNEL FUNCTION ONO PHARMACEUTICAL CO., LTD. (JP) 2021-04-29 WO disclosed
WO-2021080013-A1 INHIBITORS OF TREK (TWIK RELATED K+ CHANNELS) CHANNEL FUNCTION ONO PHARMACEUTICAL CO., LTD. (JP) 2021-04-29 WO disclosed
EP-3212647-B1 NOVEL PYRIDOPYRIMIDINONE COMPOUNDS FOR MODULATING THE CATALYTIC ACTIVITY OF HISTONE LYSINE DEMETHYLASES (KDMS) DONG A ST CO LTD (KR) 2019-04-03 EP disclosed
EP-3212647-B1 NOVEL PYRIDOPYRIMIDINONE COMPOUNDS FOR MODULATING THE CATALYTIC ACTIVITY OF HISTONE LYSINE DEMETHYLASES (KDMS) DONG A ST CO LTD (KR) 2019-04-03 EP disclosed
EP-2882749-B1 4-METHYL-2,3,5,9,9B-PENTAAZA-CYCLOPENTA[A]NAPHTHALENES BOEHRINGER INGELHEIM INT (DE) 2018-04-04 EP disclosed
EP-2882749-B1 4-METHYL-2,3,5,9,9B-PENTAAZA-CYCLOPENTA[A]NAPHTHALENES BOEHRINGER INGELHEIM INT (DE) 2018-04-04 EP disclosed
US-9926276-B2 Substituted benzamides with activity towards EP4 receptors DRACONIS PHARMA, S.L. (ES) 2018-03-27 US disclosed
US-9834550-B2 Pyridopyrimidinone compounds for modulating the catalytic activity of histone lysine demethylases (KDMs) DONG-A ST CO., LTD. (KR) 2017-12-05 US disclosed
EP-2882749-A1 4-METHYL-2,3,5,9,9B-PENTAAZA-CYCLOPENTA[A]NAPHTHALENES Boehringer Ingelheim International GmbH (DE) 2015-06-17 EP disclosed
WO-2014122267-A1 SUBSTITUTED BENZAMIDES WITH ACTIVITY TOWARDS EP4 RECEPTORS DRACONIS PHARMA, S.L. (ES) 2014-08-14 WO disclosed
EP-2765128-A1 Substituted benzamides with activity towards EP4 receptors Almirall, S.A. (ES) 2014-08-13 EP disclosed
US-20140045856-A1 4-Methyl-2,3,5,9,9b-pentaaza-cyclopenta[a]naphthalenes BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-02-13 US disclosed
US-20140045856-A1 4-Methyl-2,3,5,9,9b-pentaaza-cyclopenta[a]naphthalenes BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-02-13 US disclosed
US-20140045856-A1 4-Methyl-2,3,5,9,9b-pentaaza-cyclopenta[a]naphthalenes BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-02-13 US disclosed
US-20140045857-A1 4-Methyl-2,3,5,9,9b-pentaaza-cyclopenta[a]naphthalenes BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-02-13 US disclosed
US-20140045857-A1 4-Methyl-2,3,5,9,9b-pentaaza-cyclopenta[a]naphthalenes BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-02-13 US disclosed
US-20140045857-A1 4-Methyl-2,3,5,9,9b-pentaaza-cyclopenta[a]naphthalenes BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-02-13 US disclosed
WO-2014019979-A1 4-METHYL-2,3,5,9,9B-PENTAAZA-CYCLOPENTA[A]NAPHTHALENES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-02-06 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-20140045857-A1 4-Methyl-2,3,5,9,9b-pentaaza-cyclopenta[a]naphthalenes PDE12, PDE2A, PDE3A CA1 1649/4885CA2 592/4885CA12 1661/4885
US-20240190824-A1 INHIBITORS OF TREK (TWIK RELATED K+ CHANNELS) CHANNEL FUNCTION KCNJ11, KCNJ1, KCNJ2 CA1 2729/4885CA2 710/4885CA12 4815/4885
US-20140045856-A1 4-Methyl-2,3,5,9,9b-pentaaza-cyclopenta[a]naphthalenes PDE12, PDE2A, PDE3A CA1 1649/4885CA2 592/4885CA12 1661/4885

“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.