SCHEMBL2767787

SCHEMBL2767787

O=C(C1CCCC1)C1Cc2ccccc2CN1

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.45
MEN1 O00255 2/20 0.45
SMYD3 Q9H7B4 1/20 0.42
POLB P06746 1/20 0.41
PRCP P42785 1/20 0.41
OPRM1 P35372 1/20 0.41
OPRD1 P41143 1/20 0.41
OPRK1 P41145 1/20 0.41
PNMT P11086 1/20 0.40
BLM P54132 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
SCHEMBL4113751 1.00 KMT2A (0.45) KMT2AMEN1SMYD3POLBPRCP
Hydrochloric Acid SCHEMBL27646595 0.98 KMT2A (0.47) KMT2AMEN1SMYD3POLBPRCP
Hydrochloric Acid SCHEMBL1509727 0.98 KMT2A (0.47) KMT2AMEN1SMYD3POLBPRCP
Hydrochloric Acid SCHEMBL31263635 0.78 KMT2A (0.43) KMT2AMEN1SMYD3POLBPRCP
SCHEMBL29350565 0.78 GAA (0.58) KMT2AMEN1PRCPOPRM1OPRD1
SCHEMBL29350888 0.78 GAA (0.58) KMT2AMEN1PRCPOPRM1OPRD1
SCHEMBL43168 0.78 GAA (0.58) KMT2AMEN1PRCPOPRM1OPRD1
SCHEMBL29398238 0.78 GAA (0.58) KMT2AMEN1PRCPOPRM1OPRD1
SCHEMBL288272 0.78 GAA (0.58) KMT2AMEN1PRCPOPRM1OPRD1
SCHEMBL288260 0.78 GAA (0.58) KMT2AMEN1PRCPOPRM1OPRD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1675578-B9 INHIBITORS OF GLUTAMINYL AND GLUTAMATE CYCLASES FOR THE TREATMENT OF THE NEURODEGENERATIVE DISEASES FBD AND FDD PROBIODRUG AG (DE) 2014-06-25 EP claimed
EP-1675578-B1 INHIBITORS OF GLUTAMINYL AND GLUTAMATE CYCLASES FOR THE TREATMENT OF THE NEURODEGENERATIVE DISEASES FBD AND FDD PROBIODRUG AG (DE) 2013-05-22 EP claimed
EP-1620082-B9 MEDICAL USE OF INHIBITORS OF GLUTAMINYL AND GLUTAMATE CYCLASES FOR TREATING ALZHEIMER'S DISEASE AND DOWN SYNDROME PROBIODRUG AG (DE) 2010-08-25 EP claimed
EP-1620082-B1 MEDICAL USE OF INHIBITORS OF GLUTAMINYL AND GLUTAMATE CYCLASES FOR TREATING ALZHEIMER'S DISEASE AND DOWN SYNDROME PROBIODRUG AG (DE) 2010-04-21 EP claimed