SCHEMBL1938648

SCHEMBL1938648

CC(CNC12CC3CC(CC(C3)C1)C2)C(=O)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FAAH O00519 2/20 0.52
EPHX2 P34913 8/20 0.48
ALDH1A1 P00352 2/20 0.47
KDM4E B2RXH2 1/20 0.47
EPHX1 P07099 1/20 0.47
KMT2A Q03164 2/20 0.46
MEN1 O00255 1/20 0.46
P2RX7 Q99572 1/20 0.46
MAPK1 P28482 1/20 0.45
HDAC6 Q9UBN7 1/20 0.43
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
CNR2 P34972 1/20 0.41

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
SCHEMBL13562620 0.86 NPC1 (0.48) EPHX2ALDH1A1P2RX7HDAC6NPC1
SCHEMBL13518585 0.82 EPHX2 (0.44) FAAHEPHX2ALDH1A1KDM4EKMT2A
SCHEMBL29368906 0.74 FAAH (0.55) FAAHEPHX2ALDH1A1KDM4EEPHX1
SCHEMBL1937667 0.72 FAAH (0.56) FAAHEPHX2ALDH1A1KDM4EEPHX1
SCHEMBL8697982 0.72 PGR (0.49) ALDH1A1KDM4EKMT2AMEN1MAPK1
SCHEMBL29016421 0.71 KMT2A (0.50) ALDH1A1KDM4EKMT2AMEN1MAPK1
SCHEMBL19305014 0.70 PGR (0.47) ALDH1A1KMT2ARAB9A
SCHEMBL1421026 0.69 FAAH (1.00) FAAHEPHX2ALDH1A1KDM4EEPHX1
SCHEMBL17414388 0.69 FAAH (0.51) FAAHEPHX2ALDH1A1KDM4EEPHX1
SCHEMBL28094059 0.68 FAAH (0.50) FAAHEPHX2ALDH1A1KDM4EEPHX1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2331495-B1 PROCESS FOR MANUFACTURING ADAMANTANE DERIVATIVES WITH HIGH YIELD MERZ PHARMA GMBH & CO KGAA (DE) 2016-01-27 EP disclosed
US-8796491-B2 Process for manufacturing adamantane derivatives with high yield MERZ PHARMA GMBH & CO. KGAA (DE) 2014-08-05 US disclosed
US-20110263900-A1 PROCESS FOR MANUFACTURING ADAMANTANE DERVATIVES WITH HIGH YIELD MERZ PHARMA GMBH & CO. KGAA (DE) 2011-10-27 US disclosed
EP-2331495-A1 PROCESS FOR MANUFACTURING ADAMANTANE DERIVATIVES WITH HIGH YIELD Merz Pharma GmbH & Co. KGaA (DE) 2011-06-15 EP disclosed
WO-2010015415-A1 PROCESS FOR MANUFACTURING ADAMANTANE DERIVATIVES WITH HIGH YIELD MERZ PHARMA GMBH & CO. KGAA (DE) 2010-02-11 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-20110263900-A1 PROCESS FOR MANUFACTURING ADAMANTANE DERVATIVES WITH HIGH YIELD BACE1, BACE2, APP FAAH 285/4885EPHX2 1522/4885ALDH1A1 417/4885

“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.