SCHEMBL8097472

SCHEMBL8097472

CCCN1CCN(Cc2ccccc2)CC1

nearest known ligand 0.72

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 8/20 0.72
MC4R P32245 1/20 0.71
LMNA P02545 1/20 0.63
POLB P06746 1/20 0.63
CCR3 P51677 1/20 0.62
DRD2 P14416 1/20 0.61
DRD4 P21917 2/20 0.58
ACHE P22303 1/20 0.56
OPRM1 P35372 1/20 0.54

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
SCHEMBL6744977 1.00 SIGMAR1 (0.72) SIGMAR1MC4RLMNAPOLBCCR3
SCHEMBL6740759 0.89 CCR3 (0.69) SIGMAR1MC4RLMNAPOLBCCR3
SCHEMBL13632432 0.89 CCR3 (0.69) SIGMAR1MC4RLMNAPOLBCCR3
SCHEMBL19170201 0.89 CCR3 (0.69) SIGMAR1MC4RLMNAPOLBCCR3
SCHEMBL6659339 0.87 SIGMAR1 (0.86) SIGMAR1MC4RLMNAPOLBCCR3
SCHEMBL1244038 0.87 CCR3 (0.72) SIGMAR1MC4RLMNAPOLBCCR3
SCHEMBL8723260 0.85 CCR3 (0.70) SIGMAR1MC4RLMNAPOLBCCR3
SCHEMBL15800706 0.85 CCR3 (0.70) SIGMAR1MC4RLMNAPOLBCCR3
SCHEMBL12040820 0.85 CCR3 (0.70) SIGMAR1MC4RLMNAPOLBCCR3
SCHEMBL1415730 0.85 SIGMAR1 (1.00) SIGMAR1MC4RLMNAPOLBCCR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230234917-A1 ASPARAGINE DERIVATIVES AND METHODS OF USING SAME SENDA BIOSCIENCES INC (US) 2023-07-27 US disclosed
EP-2865669-B1 NOVEL REBAMIPIDE PRODRUG, METHOD FOR PRODUCING SAME, AND USAGE THEREOF SAMJIN PHARM CO LTD (KR) 2021-04-28 EP disclosed
EP-3180004-B1 CANCER THERAPEUTICS UNIV VIRGINIA PATENT FOUNDATION (US) 2021-01-06 EP disclosed
US-10858339-B2 Aryl cyclopropyl-amino-isoquinolinyl amide compounds AERIE PHARMACEUTICALS, INC. (US) 2020-12-08 US disclosed
US-10562890-B2 Cancer therapeutics UNIVERSITY OF VIRGINIA PATENT FOUNDATION (US) 2020-02-18 US disclosed
WO-2018089695-A1 TOLL-LIKE RECEPTOR ANTAGONIST COMPOUNDS AND METHODS OF USE DYNAVAX TECHNOLOGIES CORPORATION (US) 2018-05-17 WO disclosed
US-20180044335-A1 New Pyridinones and Isoquinolinones as Inhibitors of the Bromodomain BRD9 BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2018-02-15 US disclosed
WO-2017198339-A1 TETRAHYDROPYRAN AND THIOPYRAN DERIVATIVES HAVING MULTIMODAL ACTIVITY AGAINST PAIN LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2017-11-23 WO disclosed
US-20170233375-A1 CANCER THERAPEUTICS UNIVERSITY OF VIRGINIA PATENT FOUNDATION (US) 2017-08-17 US disclosed
US-20170233375-A1 CANCER THERAPEUTICS UNIVERSITY OF VIRGINIA PATENT FOUNDATION (US) 2017-08-17 US disclosed
US-7482352-B2 Chemical derivatives and their application as antitelomerase agents AVENTIS PHARMA S.A. (FR) 2009-01-27 US disclosed
WO-2009000878-A1 KALLIKREIN 7 MODULATORS NOVARTIS AG (CH) 2008-12-31 WO disclosed
US-20080293722-A1 Ion Channel Modulators WYETH (US) 2008-11-27 US disclosed
US-20080293722-A1 Ion Channel Modulators WYETH (US) 2008-11-27 US disclosed
EP-1606267-B1 PYRAZINE COMPOUNDS AS TRANSFORMING GROWTH FACTOR (TGF) INHIBITORS PFIZER PROD INC (US) 2008-07-30 EP disclosed
EP-1813616-A2 Pyrazoloquinolines with immunomodulating activity Active Biotech AB (SE) 2007-08-01 EP disclosed
US-7199123-B2 Pyrazine compounds as transforming growth factor (TGF) compounds PFIZER INC. (US) 2007-04-03 US disclosed
US-20070060570-A1 Sulfopyrroles TALEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-03-15 US disclosed
US-20070060570-A1 Sulfopyrroles TALEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-03-15 US disclosed
WO-2005090291-A1 ION CHANNEL MODULATORS WYETH (US) 2005-09-29 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-20170233375-A1 CANCER THERAPEUTICS RUNX1, CBFB, MCL1 SIGMAR1 3622/4885MC4R 2195/4885LMNA 3857/4885
US-20180044335-A1 New Pyridinones and Isoquinolinones as Inhibitors of the Bromodomain BRD9 BRD9, BRD1, BRD2 SIGMAR1 3476/4885MC4R 2283/4885LMNA 1902/4885
US-20070060570-A1 Sulfopyrroles TYK2, ARSA, SULT2A1 SIGMAR1 1230/4885MC4R 1385/4885LMNA 4097/4885
US-10562890-B2 Cancer therapeutics RUNX1, CBFB, MCL1 SIGMAR1 3622/4885MC4R 2195/4885LMNA 3857/4885
US-20230234917-A1 ASPARAGINE DERIVATIVES AND METHODS OF USING SAME ASNS, SI, NARS1 SIGMAR1 3788/4885MC4R 3850/4885LMNA 2652/4885
US-10858339-B2 Aryl cyclopropyl-amino-isoquinolinyl amide compounds UACA, HRAS, MYLK SIGMAR1 4116/4885MC4R 4234/4885LMNA 3205/4885
US-20080293722-A1 Ion Channel Modulators CACNA1B, CACNA1C, TRPV1 SIGMAR1 2986/4885MC4R 1604/4885LMNA 1903/4885

“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.