SCHEMBL7899320

SCHEMBL7899320

CCN1CCN(C2CCCCC2)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 2/20 0.48
SIGMAR1 Q99720 2/20 0.47
PHGDH O43175 1/20 0.47
MGLL Q99685 1/20 0.47
KMT2A Q03164 1/20 0.45
OPRM1 P35372 1/20 0.45
OPRL1 P41146 1/20 0.45
TLR7 Q9NYK1 1/20 0.44
HTR7 P34969 1/20 0.43
ALOX15 P16050 1/20 0.42
TSHR P16473 1/20 0.42
TMEM97 Q5BJF2 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
SCHEMBL13088144 1.00 HSD11B1 (0.48) HSD11B1SIGMAR1PHGDHMGLLKMT2A
SCHEMBL7907323 0.98 KMT2A (0.46) HSD11B1SIGMAR1PHGDHMGLLKMT2A
SCHEMBL23732169 0.93 KMT2A (0.46) HSD11B1SIGMAR1PHGDHMGLLKMT2A
SCHEMBL14947708 0.91 KMT2A (0.42) HSD11B1SIGMAR1PHGDHMGLLKMT2A
SCHEMBL7907325 0.88 KMT2A (0.49) HSD11B1KMT2ATLR7ALOX15
SCHEMBL11919045 0.86 KMT2A (0.56) HSD11B1KMT2A
SCHEMBL22814980 0.85 KMT2A (0.41) HSD11B1SIGMAR1PHGDHMGLLKMT2A
SCHEMBL18874058 0.84 KMT2A (0.44) HSD11B1SIGMAR1KMT2ATLR7HTR7
SCHEMBL17722606 0.84 SIGMAR1 (0.53) HSD11B1SIGMAR1PHGDHMGLLHTR7
SCHEMBL17722612 0.84 SIGMAR1 (0.53) HSD11B1SIGMAR1PHGDHMGLLHTR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024112692-A1 CASITAS B-LINEAGE LYMPHOMA PROTOONCOGENE B (CBL-B) DEGRADING COMPOUNDS AND ASSOCIATED METHODS OF USE ARVINAS OPERATIONS, INC. (US) 2024-05-30 WO disclosed
EP-3828174-A1 PYRIDAZINONE DERIVATIVE Sumitomo Dainippon Pharma Co., Ltd. (JP) 2021-06-02 EP disclosed
US-10208000-B2 Eis inhibitors UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION (US) 2019-02-19 US disclosed
US-9724435-B2 Highly selective sigma receptor ligands and radioligands as probes in nociceptive processing and the pathphysiological study of memory deficits and cognitive disorders THE UNIVERSITY OF MISSISSIPPI (US) 2017-08-08 US disclosed
US-20170174639-A1 EIS INHIBITORS UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION 2017-06-22 US disclosed
US-20160244435-A1 EXPANDED THERAPEUTIC POTENTIAL IN NITROHETEROARYL ANTIMICROBIALS THE SCRIPPS RESEARCH INSTITUTE (US) 2016-08-25 US disclosed
EP-2841414-B1 METHOD FOR ISOMERISATION OF CIS-2-PENTENNITRIL TO 3-PENTENNITRIL BASF SE (DE) 2016-06-08 EP disclosed
US-8772527-B2 Process for isomerization of cis-2-pentenenitrile to 3-pentenenitriles BASF SE (DE) 2014-07-08 US disclosed
US-20130289299-A1 Process for Isomerization of CIS-2-Pentenenitrile to 3-Pentenenitriles BASF SE (DE) 2013-10-31 US disclosed
EP-2657224-A1 Method for isomerisation of cis-2-Pentennitril to 3-Pentennitril BASF SE (DE) 2013-10-30 EP disclosed
US-20100121049-A1 INDENOISOQUINOLINONE ANALOGS AND METHODS OF USE THEREOF INOTEK PHARMACEUTICALS CORPORATION (US) 2010-05-13 US disclosed
US-20100121049-A1 INDENOISOQUINOLINONE ANALOGS AND METHODS OF USE THEREOF INOTEK PHARMACEUTICALS CORPORATION (US) 2010-05-13 US disclosed
US-20100004220-A1 Indenoisoquinolinone Analogs and Methods of Use Thereof INOTEK PHARMACEUTICALS CORPORATION 2010-01-07 US disclosed
US-7504391-B2 Selective D1/D5 receptor antagonists for the treatment of obesity and CNS disorders SCHERING CORPORATION (US) 2009-03-17 US disclosed
WO-2009021944-A1 NEW COMPOUNDS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-02-19 WO disclosed
EP-2025673-A1 Arylsulfonamides with analgetic activity Boehringer Ingelheim International GmbH (DE) 2009-02-18 EP disclosed
US-20080280910-A1 PHTHALAZINONE DERIVATIVES KUDOS PHARMACEUTICALS LIMITED (GB) 2008-11-13 US disclosed
US-20080280910-A1 PHTHALAZINONE DERIVATIVES KUDOS PHARMACEUTICALS LIMITED (GB) 2008-11-13 US disclosed
WO-2008127722-A1 METHODS FOR TREATING SPINAL MUSCULAR ATROPHY USING TETRACYCLINE COMPOUNDS PARATEK PHARMACEUTICALS, INC. (US) 2008-10-23 WO disclosed
WO-2008106619-A2 INDENOISOQUINOLINONE ANALOGS AND METHODS OF USE THEREOF INOTEK PHARMACEUTICALS CORPORATION (US) 2008-09-04 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 (7 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-20170174639-A1 EIS INHIBITORS ABCC1, ATP5ME, ABCG2 HSD11B1 2713/4885SIGMAR1 3243/4885PHGDH 376/4885
US-20160244435-A1 EXPANDED THERAPEUTIC POTENTIAL IN NITROHETEROARYL ANTIMICROBIALS NQO1, TXN2, MPO HSD11B1 2348/4885SIGMAR1 1308/4885PHGDH 813/4885
US-20130289299-A1 Process for Isomerization of CIS-2-Pentenenitrile to 3-Pentenenitriles PORCN, PIN1, ORAI2 HSD11B1 391/4885SIGMAR1 2924/4885PHGDH 1805/4885
US-20100121049-A1 INDENOISOQUINOLINONE ANALOGS AND METHODS OF USE THEREOF TNNI3, IDH2, GLS HSD11B1 1397/4885SIGMAR1 3790/4885PHGDH 1199/4885
US-20080280910-A1 PHTHALAZINONE DERIVATIVES H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, SDHA, NCOA4 HSD11B1 171/4885SIGMAR1 4134/4885PHGDH 2545/4885
US-20100004220-A1 Indenoisoquinolinone Analogs and Methods of Use Thereof TNNI3, IDH2, GLS HSD11B1 1397/4885SIGMAR1 3790/4885PHGDH 1199/4885
US-10208000-B2 Eis inhibitors ABCC1, ATP5ME, ABCG2 HSD11B1 2713/4885SIGMAR1 3243/4885PHGDH 376/4885

“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.