SCHEMBL2941482

SCHEMBL2941482

[CH]1[CH]CN(Cc2ccccc2)C1

nearest known ligand 0.74

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 4/20 0.65
MC4R P32245 1/20 0.54
DRD4 P21917 1/20 0.52
LMNA P02545 1/20 0.52
POLB P06746 1/20 0.52
FUCA1 P04066 2/20 0.50
ALDH1A1 P00352 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
ACHE P22303 1/20 0.50
CYP3A4 P08684 1/20 0.48
HSD17B10 Q99714 1/20 0.48
CCR3 P51677 1/20 0.48

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
SCHEMBL155000 0.85 SIGMAR1 (0.65) SIGMAR1MC4RDRD4LMNAPOLB
SCHEMBL1639608 0.85 SIGMAR1 (0.65) SIGMAR1MC4RDRD4LMNAPOLB
SCHEMBL1041303 0.79 SIGMAR1 (1.00) SIGMAR1MC4RDRD4LMNAPOLB
SCHEMBL242970 0.79 SIGMAR1 (1.00) SIGMAR1MC4RDRD4LMNAPOLB
SCHEMBL1639911 0.79 SIGMAR1 (0.71) SIGMAR1MC4RDRD4LMNAPOLB
SCHEMBL1415730 0.79 SIGMAR1 (1.00) SIGMAR1MC4RDRD4LMNAPOLB
SCHEMBL576868 0.79 SIGMAR1 (1.00) SIGMAR1MC4RDRD4LMNAPOLB
SCHEMBL8188324 0.79 SIGMAR1 (1.00) SIGMAR1MC4RDRD4LMNAPOLB
SCHEMBL2489199 0.79 SIGMAR1 (1.00) SIGMAR1MC4RDRD4LMNAPOLB
SCHEMBL4448723 0.77 SIGMAR1 (0.68) SIGMAR1MC4RDRD4LMNAPOLB

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-10544095-B2 3-indol substituted derivatives, pharmaceutical compositions and methods for use PFIZER INC. (US) 2020-01-28 US disclosed
EP-2567951-B1 CATIONIC LIPID KYOWA HAKKO KIRIN CO LTD (JP) 2018-09-19 EP disclosed
EP-3334733-A1 3-INDOL SUBSTITUTED DERIVATIVES, PHARMACEUTICAL COMPOSITIONS AND METHODS FOR USE Pfizer Inc (US) 2018-06-20 EP disclosed
EP-3301086-A1 PRODUCTION OF A COMPOSITION CONTAINING A COMPLEX BETWEEN A MEMBRANE COMPOSED OF A LIPID MONOLAYER AND A NUCLEIC ACID, AND, A LIPID MEMBRANE FOR ENCAPSULATING THE COMPLEX THEREIN Kyowa Hakko Kirin Co., Ltd. (JP) 2018-04-04 EP disclosed
US-9920028-B2 Cationic lipid KYOWA HAKKO KIRIN CO., LTD. (JP) 2018-03-20 US disclosed
US-20170349532-A1 CATIONIC LIPID KYOWA HAKKO KIRIN CO., LTD. (JP) 2017-12-07 US disclosed
WO-2017025868-A1 3-INDOL SUBSTITUTED DERIVATIVES, PHARMACEUTICAL COMPOSITIONS AND METHODS FOR USE PFIZER INC. (US) 2017-02-16 WO disclosed
US-20160304487-A1 CATIONIC LIPID KYOWA HAKKO KIRIN CO LTD (JP) 2016-10-20 US disclosed
EP-2774912-A1 CATIONIC LIPID Kyowa Hakko Kirin Co., Ltd. (JP) 2014-09-10 EP disclosed
US-20130108685-A1 CATIONIC LIPID KYOWA KIRIN CO., LTD. (JP) 2013-05-02 US disclosed
EP-1776395-B1 POLYMERIZATION CATALYSTS, MAIN GROUP COORDINATION COMPOUNDS, PROCESS FOR PREPARING POLYOLEFINS AND POLYOLEFINS BASELL POLYOLEFINE GMBH (DE) 2010-10-13 EP disclosed
US-7750097-B2 Polymerization catalysts, main group coordination compounds, process for preparing polyolefins and polyolefins BASELL POLYOLEFINE GMBH (DE) 2010-07-06 US disclosed
US-7544749-B2 Polymerization catalysts, organic transition metal compounds, process for preparing polyolefins and polyolefins BASELL POLYOLEFINE GMBH (DE) 2009-06-09 US disclosed
US-20080021182-A1 Polymerization Catalysts, Main Group Coordination Compounds, Process For Preparing Polyolefins And Polyolefins BASELL POLYOLEFINE GMBH (DE) 2008-01-24 US disclosed
EP-1590377-B1 POLYMERIZATION CATALYSTS, ORGANIC TRANSITION METAL COMPOUNDS, PROCESS FOR PREPARING POLYOLEFINS BASELL POLYOLEFINE GMBH (DE) 2007-06-13 EP disclosed
EP-1776395-A1 POLYMERIZATION CATALYSTS, MAIN GROUP COORDINATION COMPOUNDS, PROCESS FOR PREPARING POLYOLEFINS AND POLYOLEFINS Basell Polyolefine GmbH (DE) 2007-04-25 EP disclosed
US-20060100092-A1 Polymerization catalysts, organic transition metal compounds, process for preparing polyolefins and polyolefins BASELL POLYOLEFINE GMBH (DE) 2006-05-11 US disclosed
WO-2006002923-A1 POLYMERIZATION CATALYSTS, MAIN GROUP COORDINATION COMPOUNDS, PROCESS FOR PREPARING POLYOLEFINS AND POLYOLEFINS BASELL POLYOLEFINE GMBH (DE) 2006-01-12 WO disclosed
EP-1590377-A1 POLYMERIZATION CATALYSTS, ORGANIC TRANSITION METAL COMPOUNDS, PROCESS FOR PREPARING POLYOLEFINS AND POLYOLEFINS Basell Polyolefine GmbH (DE) 2005-11-02 EP disclosed
WO-2004069881-A1 POLYMERIZATION CATALYSTS, ORGANIC TRANSITION METAL COMPOUNDS, PROCESS FOR PREPARING POLYOLEFINS AND POLYOLEFINS BASELL POLYOLEFINE GMBH (DE) 2004-08-19 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 (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-20160304487-A1 CATIONIC LIPID LPAR3, ACOX3, H1-3 SIGMAR1 143/4885MC4R 3589/4885DRD4 1592/4885
US-20170349532-A1 CATIONIC LIPID LPAR3, ACOX3, H1-3 SIGMAR1 143/4885MC4R 3589/4885DRD4 1592/4885
US-20080021182-A1 Polymerization Catalysts, Main Group Coordination Compounds, Process For Preparing Polyolefins And Polyolefins PCNA, PARG, TST SIGMAR1 3262/4885MC4R 3734/4885DRD4 1196/4885
US-10544095-B2 3-indol substituted derivatives, pharmaceutical compositions and methods for use TDO2, IDO1, IDO2 SIGMAR1 1168/4885MC4R 845/4885DRD4 427/4885
US-20130108685-A1 CATIONIC LIPID LPAR3, ACOX3, H1-3 SIGMAR1 143/4885MC4R 3589/4885DRD4 1592/4885

“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.