SCHEMBL633802

SCHEMBL633802

CC1(N2CCCCC2)CCCCC1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN1 Q05586 3/20 0.37
GRIN2A Q12879 3/20 0.37
GRIN2B Q13224 3/20 0.37
PRCP P42785 2/20 0.37
SIGMAR1 Q99720 2/20 0.37
GRIN2D O15399 1/20 0.37
GRIN3B O60391 1/20 0.37
CYP2B6 P20813 1/20 0.37
SLC6A2 P23975 1/20 0.37
SLC6A4 P31645 1/20 0.37
SLC6A3 Q01959 1/20 0.37
KCNH2 Q12809 1/20 0.37
GRIN2C Q14957 1/20 0.37
GRIN3A Q8TCU5 1/20 0.37
OPRM1 P35372 7/20 0.37
OPRL1 P41146 5/20 0.37
OPRD1 P41143 5/20 0.35
CCR5 P51681 1/20 0.35
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL1515302 1.00 GRIN1 (0.37) GRIN1GRIN2AGRIN2BPRCPSIGMAR1
SCHEMBL13300994 1.00 GRIN1 (0.37) GRIN1GRIN2AGRIN2BPRCPSIGMAR1
SCHEMBL6496554 1.00 GRIN1 (0.37) GRIN1GRIN2AGRIN2BPRCPSIGMAR1
Hydrochloric Acid SCHEMBL9277821 0.97 OPRM1 (0.39) GRIN1GRIN2AGRIN2BPRCPSIGMAR1
Iodide SCHEMBL28150638 0.97 OPRM1 (0.36) GRIN1GRIN2AGRIN2BPRCPSIGMAR1
Water SCHEMBL28150547 0.97 OPRM1 (0.36) GRIN1GRIN2AGRIN2BPRCPSIGMAR1
SCHEMBL10856987 0.97 OPRM1 (0.34) GRIN1GRIN2AGRIN2BPRCPSIGMAR1
SCHEMBL27466489 0.95 CCR5 (0.36) GRIN1GRIN2AGRIN2BPRCPSIGMAR1
SCHEMBL10862803 0.94 OPRM1 (0.33) GRIN1GRIN2AGRIN2BPRCPSIGMAR1
SCHEMBL24176112 0.92

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117003199-A Dehydrogenation method and hydrogen production system using same 现代自动车株式会社 2023-11-07 CN claimed
US-20230348266-A1 DEHYDROGENATION METHOD AND HYDROGEN PRODUCTION SYSTEM USING THE SAME HYUNDAI MOTOR COMPANY (KR) 2023-11-02 US claimed
WO-2021119464-A1 COMPOSITIONS AND MODULAR NANO- AND MICROPARTICLES FOR THE DELIVERY OF VARIOUS AGENTS AND USE THEREOF VERI NANO INC. (US) 2021-06-17 WO claimed
CN-104245585-A Process for preparing aluminosilicate zeolite SSZ-33 CHEVRON USA INC 2014-12-24 CN claimed
WO-2012044963-A2 PERFLUOROCARBONS FOR USE IN TREATING PRURITUS OXYGEN BIOTHERAPEUTICS, INC. (US) 2012-04-05 WO claimed
EP-2419392-A2 EMULSIONS OF PERFLUOROCARBONS Oxygen Biotherapeutics, Inc. (US) 2012-02-22 EP claimed
WO-2010121082-A2 EMULSIONS OF PERFLUOROCARBONS OXYGEN BIOTHERAPEUTICS, INC. (US) 2010-10-21 WO claimed
CN-117003199-A Dehydrogenation method and hydrogen production system using same 现代自动车株式会社 2023-11-07 CN disclosed
US-20230348266-A1 DEHYDROGENATION METHOD AND HYDROGEN PRODUCTION SYSTEM USING THE SAME HYUNDAI MOTOR COMPANY (KR) 2023-11-02 US disclosed
WO-2021119464-A1 COMPOSITIONS AND MODULAR NANO- AND MICROPARTICLES FOR THE DELIVERY OF VARIOUS AGENTS AND USE THEREOF VERI NANO INC. (US) 2021-06-17 WO disclosed
EP-2758034-A1 COMPOSITIONS AND METHODS FOR MOLECULAR IMAGING OF OXYGEN METABOLISM Rockland Technimed Ltd. (US) 2014-07-30 EP disclosed
WO-2013043236-A1 COMPOSITIONS AND METHODS USEFUL FOR REALTIME IN SITU PHYSIOLOGICAL MOLECULAR IMAGING OF OXYGEN METABOLISM ROCKLAND TECHNIMED, LTD. (US) 2013-03-28 WO disclosed
WO-2013044186-A1 COMPOSITIONS AND METHODS FOR MOLECULAR IMAGING OF OXYGEN METABOLISM ROCKLAND TECHNIMED, LTD. (US) 2013-03-28 WO disclosed
US-6696566-B2 SELECTIVE P38 KINASE INHIBITORS RELATIVE TO CYCLIN-DEPENDENT KINASES AND TYROSINE KINASES SYNTEX (U.S.A.) LLC 2004-02-24 US disclosed
EP-1361880-A2 6-SUBSTITUTED PYRIDO-PYRIMIDINES F. HOFFMANN-LA ROCHE AG (CH) 2003-11-19 EP disclosed
CN-1454084-A Emulsion of perfluororganic compounds for medical purposes, method for producing said emulsion and methods for curing and preventing diseases with the aid of the emulsion OTKRYTOE AKTSIONERNOE OBSCHEST (RU) 2003-11-05 CN disclosed
US-20030171584-A1 Treating p38 mediated disorders such as arthritis, Crohns disease, irritable bowel syndrome adult respiratory distress syndrome or chronic obstructive pulmonary disease. SYNTEX (U.S.A.) LLC 2003-09-11 US disclosed
WO-2002064594-A2 6-SUBSTITUTED PYRIDO-PYRIMIDINES F. HOFFMANN-LA ROCHE AG (CH) 2002-08-22 WO disclosed
EP-0666736-A1 STABILIZATION OF FLUOROCARBON EMULSIONS. ALLIANCE PHARMA (US) 1995-08-16 EP disclosed
WO-1994009625-A2 STABILIZATION OF FLUOROCARBON EMULSIONS ALLIANCE PHARMACEUTICAL CORP. (US) 1994-05-11 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 (1 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-20030171584-A1 Treating p38 mediated disorders such as arthritis, Crohns disease, irritable bowel syndrome adult respiratory distress syndrome or chronic obstructive pulmonary disease. ARRB1, MAPK1, MAPK8 GRIN1 618/4885GRIN2A 1452/4885GRIN2B 1671/4885

“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.