SCHEMBL2401189

SCHEMBL2401189

C1CCC2=NCCCN2CC1.C1CCC2=NCCCN2CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
INMT O95050 4/20 1.00
USP2 O75604 2/20 1.00
ACHE P22303 6/20 0.38
NOS3 P29474 4/20 0.36
NOS1 P29475 4/20 0.36
NOS2 P35228 4/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
ALDH1A1 P00352 2/20 0.34
TSHR P16473 1/20 0.34
LMNA P02545 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL10601682 1.00 INMT (1.00) INMTUSP2ACHENOS3NOS1
SCHEMBL16583523 1.00 INMT (1.00) INMTUSP2ACHENOS3NOS1
SCHEMBL17417853 1.00 INMT (1.00) INMTUSP2ACHENOS3NOS1
SCHEMBL6853620 1.00 INMT (1.00) INMTUSP2ACHENOS3NOS1
SCHEMBL2734323 1.00 INMT (1.00) INMTUSP2ACHENOS3NOS1
SCHEMBL3047 1.00 INMT (1.00) INMTUSP2ACHENOS3NOS1
Iodide SCHEMBL23365018 0.98 INMT (0.95) INMTUSP2ACHENOS3NOS1
Ammonia Solution, Strong SCHEMBL6834929 0.98 INMT (0.95) INMTUSP2ACHENOS3NOS1
Bromide SCHEMBL8469764 0.98 INMT (0.95) INMTUSP2ACHENOS3NOS1
SCHEMBL2544511 0.98 INMT (0.95) INMTUSP2ACHENOS3NOS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4332111-A1 METHOD FOR PRODUCING OLIGONUCLEIC ACID COMPOUND Nippon Shinyaku Co., Ltd. (JP) 2024-03-06 EP disclosed
EP-4242216-A2 ELECTRONIC DEVICE AND COMPOUND Novaled GmbH (DE) 2023-09-13 EP disclosed
EP-2776447-B2 METHOD FOR PRODUCING OXO-VINYL-IONOL AND O-PROTECTED DERIVATIVES THEREOF BASF SE (DE) 2022-01-05 EP disclosed
EP-3319955-B1 6-AMINO-QUINOLINE-3-CARBONITRILS AS COT MODULATORS GILEAD SCIENCES INC (US) 2020-11-25 EP disclosed
EP-3667752-A1 ELECTRONIC DEVICE AND COMPOUND Novaled GmbH (DE) 2020-06-17 EP disclosed
EP-2724388-B1 ELECTRONIC DEVICE NOVALED GMBH (DE) 2020-03-11 EP disclosed
US-20190241610-A1 SYNTHETIC PEPTIDE AMIDES CARA THERAPEUTICS, INC. (US) 2019-08-08 US disclosed
EP-2776447-B1 METHOD FOR PRODUCING OXO-VINYL-IONOL AND O-PROTECTED DERIVATIVES THEREOF BASF SE (DE) 2018-05-30 EP disclosed
EP-2703392-B1 5-MEMBERED RING AROMATIC HETEROCYCLIC DERIVATIVE HAVING NPY Y5 RECEPTOR ANTAGONISTIC ACTIVITY SHIONOGI & CO (JP) 2017-06-14 EP disclosed
US-20160376308-A1 SYNTHETIC PEPTIDE AMIDES AND DIMERS THEREOF CARA THERAPEUTICS, INC. (US) 2016-12-29 US disclosed
WO-2013017564-A2 METHOD FOR THE MANUFACTURE OF COMPOUNDS CONTAINING AN ALPHA-OXY PHOSPHORUS GROUP BY USING P-X COMPONENTS STRAITMARK HOLDING AG (CH) 2013-02-07 WO disclosed
WO-2012175219-A1 ELECTRONIC DEVICE AND COMPOUND NOVALED AG (DE) 2012-12-27 WO disclosed
EP-2064228-B1 SYNTHETIC PEPTIDE AMIDES CARA THERAPEUTICS INC (US) 2012-08-29 EP disclosed
US-8236766-B2 Uses of synthetic peptide amides CARA THERAPEUTICS, INC. (US) 2012-08-07 US disclosed
US-20110212882-A1 USES OF KAPPA OPIOID SYNTHETIC PEPTIDE AMIDES CARA THERAPEUTICS, INC. (US) 2011-09-01 US disclosed
EP-1636224-B1 PYRROLOPYRIDINE-2-CARBOXYLIC ACID AMIDE INHIBITORS OF GLYCOGEN PHOSHORYLASE PROSIDION LTD (GB) 2010-07-14 EP disclosed
US-20100075910-A1 SYNTHETIC PEPTIDE AMIDES AND DIMERIC FORMS THEREOF CARA THERAPEUTICS, INC. (US) 2010-03-25 US disclosed
WO-2009016663-A1 AMPHIPHILIC DEXTRIN CONJUGATES AND THEIR USE IN PHARMACEUTICAL FORMULATIONS AS COMPLEXING AGENTS FOR HYDROPHOBIC DRUGS TO IMPROVE THE AQUEOUS SOLUBILITY AND CONSEQUENTLY THE THERAPEUTIC EFFICACY OF THE COMPLEXED DRUGS ISTITUTO GIANNINA GASLINI (IT) 2009-02-05 WO disclosed
US-20020028939-A1 Bicyclic amidines, process for their preparation, and their use as catalyst WERBITZKY OLEG (CH) 2002-03-07 US disclosed
US-6255488-B1 BICYCLIC AMIDINES HAVING AMINO, HYDROXYL, AND/OR MERCAPTO GROUPS USEFUL AS CATALYSTS FOR PREPARATION OF POLYURETHANES; WHICH BOND FIRMLY TO THE POLYMER WITH NO TENDENCY TOWARDS MIGRATION LONZA AG (CH) 2001-07-03 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 (5 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-20020028939-A1 Bicyclic amidines, process for their preparation, and their use as catalyst CBR1, CBR3, RER1 INMT 1116/4885USP2 3077/4885ACHE 2601/4885
US-20160376308-A1 SYNTHETIC PEPTIDE AMIDES AND DIMERS THEREOF OPRK1, OPRL1, OPRM1 INMT 1907/4885USP2 1819/4885ACHE 645/4885
US-20190241610-A1 SYNTHETIC PEPTIDE AMIDES OPRK1, OPRL1, OPRD1 INMT 2197/4885USP2 2214/4885ACHE 619/4885
US-20100075910-A1 SYNTHETIC PEPTIDE AMIDES AND DIMERIC FORMS THEREOF OPRK1, OPRD1, OPRM1 INMT 2434/4885USP2 2376/4885ACHE 544/4885
US-20110212882-A1 USES OF KAPPA OPIOID SYNTHETIC PEPTIDE AMIDES OPRK1, OGFR, MMP13 INMT 288/4885USP2 3196/4885ACHE 384/4885

“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.