SCHEMBL7259186

SCHEMBL7259186

C1C2CC3CC1CC(CC14CC5CC(CC(C5)C1)C4)(C2)C3

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 5/20 0.58
GRIN3B O60391 5/20 0.58
GRIN1 Q05586 5/20 0.58
GRIN2A Q12879 5/20 0.58
GRIN2B Q13224 5/20 0.58
GRIN2C Q14957 5/20 0.58
GRIN3A Q8TCU5 5/20 0.58
ALDH1A1 P00352 3/20 0.48
TSHR P16473 2/20 0.48
LMNA P02545 2/20 0.42
SLC22A2 O15244 1/20 0.42
SLC22A1 O15245 1/20 0.42
NFKB1 P19838 1/20 0.42
STAT6 P42226 1/20 0.42
SLC47A1 Q96FL8 1/20 0.42
SIGMAR1 Q99720 1/20 0.42
POLB P06746 1/20 0.40
THRB P10828 1/20 0.40
BLM P54132 1/20 0.40
PMP22 Q01453 1/20 0.40

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
SCHEMBL11697939 0.79 GRIN2D (0.68) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL6938218 0.74 GRIN2D (0.41) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL863348 0.73 GRIN2D (0.52) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL236360 0.73 GRIN2D (0.52) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL17348246 0.73 GRIN2D (0.52) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL5149317 0.73 GRIN2D (0.52) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL15628114 0.73 GRIN2D (0.52) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL5598527 0.73 GRIN2D (0.52) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL10957944 0.73 GRIN2D (0.76) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL140991 0.73 GRIN2D (0.52) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240142433-A1 METHOD FOR DETECTING AROMATIC HYDROCARBONS AND/OR DIAMONDOIDS USING FOURIER TRANSFORM ION CYCLOTRONIC RESONANCE MASS SPECTROMETRY COUPLED WITH THE ATMOSPHERIC PRESSURE PHOTOIONIZATION SOURCE UNIVERSIDADE FEDERAL DE GOIÁS (BR) 2024-05-02 US disclosed
EP-3334801-A1 MATERIAL COMBINATION Merck Patent GmbH (DE) 2018-06-20 EP disclosed
WO-2017025167-A1 MATERIAL COMBINATION MERCK PATENT GMBH (DE) 2017-02-16 WO disclosed
EP-1346730-A1 Pretargeting methods and novel pretargeting conjugates NEORX CORPORATION (US) 2003-09-24 EP disclosed
US-6217869-B1 ADMINISTERING ANTIBODY, ANTIGEN, LIGAND COMPLEX NEORX CORPORATION 2001-04-17 US disclosed
US-6015897-A FOR CONJUGATION TO LIGAND/ANTILIGAND PAIR AND USE IN DELIVERY OF THERAPEUTIC OR DIAGNOSTIC AGENT TO TARGETED SITE NEORX CORPORATION (US) 2000-01-18 US disclosed
EP-0733066-A4 PRETARGETING METHODS AND COMPOUNDS NEORX CORP (US) 1999-04-21 EP disclosed
EP-0733066-A1 PRETARGETING METHODS AND COMPOUNDS NEORX CORPORATION (US) 1996-09-25 EP disclosed
WO-1995015979-A1 PRETARGETING METHODS AND COMPOUNDS NEORX CORPORATION (US) 1995-06-15 WO disclosed
EP-0158996-B1 PERFLUORO CARBON COMPOUND AQUEOUS DISPERSIONS AFFINITY BIOTECH, INC. (US) 1991-12-04 EP disclosed
EP-0120641-A2 Fluorocarbon tracers and tracing method ADAMANTECH, INC. (US) 1984-10-03 EP disclosed
EP-0031353-B1 USE OF PERFLUOROCARBON AS BURN TREATMENT SUNTECH, INC. (US) 1984-08-08 EP disclosed
US-4461717-A PERFLUORINATED C9-C18 POLYCYCLIC HYDROCARBONS WITH AMIDOAMINE OXIDE SURFACTANT SUN TECH, INC. (US) 1984-07-24 US disclosed
EP-0105584-A1 Perfluorocarbon emulsions and their preparation and use in therapy ADAMANTECH, INC. (US) 1984-04-18 EP disclosed
WO-1984000686-A1 PERFLUOROCARBON EMULSIONS AND THEIR PREPARATION AND USE IN THERAPY SUN TECH INC (US) 1984-03-01 WO disclosed
US-4366169-A Use of perfluorocarbons as wound treatment SUN TECH, INC. (US) 1982-12-28 US disclosed
EP-0031353-A4 USE OF PERFLUOROCARBON AS BURN TREATMENT. SUNTECH (US) 1982-07-06 EP disclosed
EP-0031353-A1 USE OF PERFLUOROCARBON AS BURN TREATMENT. SUNTECH (US) 1981-07-08 EP disclosed
WO-1981000002-A1 USE OF PERFLUOROCARBON AS BURN TREATMENT SUNTECH (US) 1981-01-08 WO disclosed
US-4105798-A Perfluoro polycyclic compounds for use as synthetic blood and perfusion media SUN VENTURES, INC. (US) 1978-08-08 US disclosed