SCHEMBL3102552

SCHEMBL3102552

COc1ccc(-n2cnnn2)cc1CN[C@@H]1CCCN[C@@H]1c1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 19/20 1.00

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
SCHEMBL29543526 1.00 TACR1 (1.00) TACR1
SCHEMBL3102542 1.00 TACR1 (1.00) TACR1
SCHEMBL2487997 1.00 TACR1 (1.00) TACR1
SCHEMBL8432621 1.00 TACR1 (1.00) TACR1
Hydrochloric Acid SCHEMBL8529468 0.99 TACR1 (1.00) TACR1
Hydrochloric Acid SCHEMBL29907288 0.99 TACR1 (1.00) TACR1
Hydrochloric Acid SCHEMBL8529474 0.99 TACR1 (1.00) TACR1
Hydrochloric Acid SCHEMBL8533298 0.99 TACR1 (1.00) TACR1
Hydrochloric Acid SCHEMBL8545811 0.99 TACR1 (1.00) TACR1
Hydrochloric Acid SCHEMBL17105739 0.98 TACR1 (0.97) TACR1

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
US-20220218663-A1 METHOD FOR PREVENTING AND/OR TREATING CHRONIC TRAUMATIC ENCEPHALOPATHY-I EUSTRALIS PHARMACEUTICALS LIMITED (TRADING AS PRESSURA NEURO) (AU) 2022-07-14 US disclosed
US-10729677-B2 Method for preventing and/or treating chronic traumatic encephalopathy-I EUSTRALIS PHARMACEUTICAL LIMITED (TRADING AS PRESSURA NEURO) (AU) 2020-08-04 US disclosed
EP-3016642-B1 METHOD FOR PREVENTING AND/OR TREATING CHRONIC TRAUMATIC ENCEPHALOPATHY-I EUSTRALIS PHARMACEUTICALS LTD TRADING AS PRESSURA NEURO (AU) 2019-03-13 EP disclosed
US-10201568-B2 Brain, spinal, and nerve injury treatment EUSTRALIS PHARMACEUTICALS LIMITED (AU) 2019-02-12 US disclosed
US-20180071333-A1 BRAIN, SPINAL, AND NERVE INJURY TREATMENT EUSTRALIS PHARMACEUTICALS LIMITED (AU) 2018-03-15 US disclosed
US-20160143881-A1 METHOD FOR PREVENTING AND/OR TREATING CHRONIC TRAUMATIC ENCEPHALOPATHY-I EUSTRALIS PHARMACETICALS LIMITED (TRADING AS PRESSURA NEURO) (AU) 2016-05-26 US disclosed
US-20160030474-A1 Brain, Spinal and Nerve Injury Treatment EUSTRALIS PHARMACEUTICALS LIMITED (AU) 2016-02-04 US disclosed
US-9186404-B2 Brain, spinal and nerve injury treatment EUSTRALIS PHARMACEUTICALS LIMITED (AU) 2015-11-17 US disclosed
US-20100311803-A1 METHOD FOR REDUCING INFLAMMATORY RESPONSES AND INFLAMMATION ADELAIDE RESEARCH & INNOVATION PTY LTD 2010-12-09 US disclosed
US-20100305183-A1 METHOD AND COMPOSITION FOR REDUCING REPERFUSION INJURY ADELAIDE RESEARCH & INNOVATION PTY LTD 2010-12-02 US disclosed
US-20050107380-A1 Brain, spinal and nerve injury treatment EUSTRALIS PHARMACEUTICALS LIMITED (AU) 2005-05-19 US disclosed
US-6841551-B2 Brain, spinal, and nerve injury treatment HOFFMANN-LA ROCHE INC. (US) 2005-01-11 US disclosed
EP-1261335-A4 BRAIN, SPINAL AND NERVE INJURY TREATMENT HOFFMANN LA ROCHE (CH) 2004-09-22 EP disclosed
EP-1261335-A1 BRAIN, SPINAL AND NERVE INJURY TREATMENT F.HOFFMANN-LA ROCHE AG (CH) 2002-12-04 EP disclosed
WO-2001052844-A1 BRAIN, SPINAL AND NERVE INJURY TREATMENT F. HOFFMANN-LA ROCHE AG (CH) 2001-07-26 WO disclosed
US-5843966-A Piperidine derivatives GLAXO GROUP LIMITED (GB) 1998-12-01 US disclosed
EP-0720609-B1 3-(5-TETRAZOLYL-BENZYL)AMINO-PIPERIDINE DERIVATIVES AND ANTAGONISTS OF TACHYKININS GLAXO GROUP LTD (GB) 1998-11-11 EP disclosed
US-5703240-A ANALGESICS; ANTIINFLAMMATORY AGENTS; NERVOUS SYSTEM DISORDERS; PSYCHOLOGICAL DISORDERS; GASTROINTESTINAL DISORDERS GLAXO GROUP LIMITED (GB) 1997-12-30 US disclosed
EP-0720609-A1 3-(5-TETRAZOLYL-BENZYL)AMINO-PIPERIDINE DERIVATIVES AND ANTAGONISTS OF TACHYKININS GLAXO GROUP LIMITED (GB) 1996-07-10 EP disclosed
WO-1995008549-A1 3-(5-TETRAZOLYL-BENZYL)AMINO-PIPERIDINE DERIVATIVES AND ANTAGONISTS OF TACHYKININS GLAXO GROUP LIMITED (GB) 1995-03-30 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 (4 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-20180071333-A1 BRAIN, SPINAL, AND NERVE INJURY TREATMENT TACR1, TACR2, NPSR1 TACR1 1/4885
US-20050107380-A1 Brain, spinal and nerve injury treatment TACR1, TACR2, NMUR1 TACR1 1/4885
US-20160030474-A1 Brain, Spinal and Nerve Injury Treatment TACR1, TACR2, NMUR1 TACR1 1/4885
US-10201568-B2 Brain, spinal, and nerve injury treatment TACR1, TACR2, NPSR1 TACR1 1/4885

“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.