SCHEMBL1737795

SCHEMBL1737795

CN1CCN(c2ccccc2CC2CCN(c3ccc(C(=O)N4CCOCC4)cc3)C2=O)CC1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HPGD P15428 6/20 0.46
KMT2A Q03164 1/20 0.46
ALDH1A1 P00352 2/20 0.43
KDM4E B2RXH2 2/20 0.42
MAPT P10636 2/20 0.42
HRH3 Q9Y5N1 1/20 0.42
POLB P06746 1/20 0.41
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HSD11B1 P28845 1/20 0.40
CYP3A4 P08684 1/20 0.40
DPP4 P27487 1/20 0.40
PRMT5 O14744 2/20 0.39
OPRM1 P35372 1/20 0.39
OPRD1 P41143 1/20 0.39

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
SCHEMBL1738643 0.93 KDM4E (0.48) HPGDKMT2AALDH1A1KDM4EMAPT
SCHEMBL1737848 0.91 MAPT (0.46) HPGDKMT2AALDH1A1KDM4EMAPT
SCHEMBL1739591 0.91 MAPT (0.46) HPGDKMT2AALDH1A1KDM4EMAPT
SCHEMBL1737845 0.91 MAPT (0.46) HPGDKMT2AALDH1A1KDM4EMAPT
SCHEMBL1738449 0.89 ROCK2 (0.42) KMT2AALDH1A1KDM4EMAPTPOLB
SCHEMBL1738781 0.89 ROCK2 (0.42) KMT2AALDH1A1KDM4EMAPTPOLB
SCHEMBL1737229 0.89 ROCK2 (0.42) KMT2AALDH1A1KDM4EMAPTPOLB
SCHEMBL6434969 0.82 ROCK2 (0.44) KMT2AMAPTHRH3POLBSMN1; SMN2
SCHEMBL1738372 0.81 TRPV4 (0.45) HPGDKMT2AALDH1A1KDM4EMAPT
SCHEMBL1738789 0.81 TRPV4 (0.45) HPGDKMT2AALDH1A1KDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1727794-B1 NOVEL BENZYL(IDENE)-LACTAM DERIVATIVES PFIZER PROD INC (US) 2011-11-16 EP claimed
US-20110263484-A1 SINGLE CHAIN FC TYPE III INTERFERONS AND METHODS OF USING SAME ZYMOGENETICS, INC. 2011-10-27 US claimed
US-7479559-B2 3-[-2-(Piperazin-1-yl)benzyl]pyrrolidin-2-one derivatives; antidepressants, anxiolytic agents; obsessive compulsive disorder, psychological disorders, phobias; 5-HT1 agonist or antagonists; side effect reduction, in particular cardiac QTc prolongation; hydrogenation PFIZER INC. (US) 2009-01-20 US claimed
EP-1727794-B1 NOVEL BENZYL(IDENE)-LACTAM DERIVATIVES PFIZER PROD INC (US) 2011-11-16 EP disclosed
US-20110263484-A1 SINGLE CHAIN FC TYPE III INTERFERONS AND METHODS OF USING SAME ZYMOGENETICS, INC. 2011-10-27 US disclosed
CN-1934081-A Novel benayl(idene)-lactam derivatives PFIZER (US) 2007-03-21 CN disclosed
WO-2007026219-A2 COMBINATIONS OF A 5-HT1B ANTAGONIST WITH A NORADRENALIN RE-UPTAKE INHIBITOR OR A SEROTONIN NORADRENALIN REUTAKE INHIBITOR FOR TREATING CNS CONDITIONS PFIZER PRODUCTS INC. (US) 2007-03-08 WO disclosed
WO-2007026224-A2 5-HT1B ANTAGONIST COMPOSITION FOR DEPRESSION, ANXIETY AND COGNITION PFIZER PRODUCTS INC. (US) 2007-03-08 WO disclosed