SCHEMBL248793

SCHEMBL248793

O=C1C=CC=CCN1CCCNCc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.45
ACHE P22303 5/20 0.45
CHRM2 P08172 1/20 0.44
SIGMAR1 Q99720 3/20 0.42
DPP7 Q9UHL4 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
HDAC3 O15379 2/20 0.39
HDAC1 Q13547 2/20 0.39
HDAC2 Q92769 2/20 0.39
HDAC8 Q9BY41 2/20 0.39
NCOR2 Q9Y618 2/20 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
SCHEMBL248792 0.72 ACHE (0.49) MAOAACHECHRM2SIGMAR1DPP7
SCHEMBL14068417 0.69 CD274 (0.59) DPP7MEN1KMT2ATDP1
SCHEMBL2444736 0.69 DPP7 (0.69) MAOACHRM2SIGMAR1DPP7MEN1
SCHEMBL6846959 0.68 MAOA (0.47) MAOAACHECHRM2SIGMAR1DPP7
SCHEMBL4663313 0.67 GSK3A (0.55) MAOAACHESIGMAR1MEN1KMT2A
SCHEMBL8541296 0.67 ACHE (0.88) ACHETDP1
SCHEMBL4932707 0.67 MAOA (0.95) MAOACHRM2SIGMAR1MEN1KMT2A
SCHEMBL893154 0.67 MAOA (0.86) MAOACHRM2SIGMAR1MEN1KMT2A
SCHEMBL13327059 0.67 MEN1 (0.59) MAOAACHECHRM2SIGMAR1DPP7
SCHEMBL249046 0.66 MAOA (0.58) MAOAACHECHRM2SIGMAR1DPP7

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
US-8968869-B2 Curable-on-demand polysiloxane coating composition 3M INNOVATIVE PROPERTIES COMPANY (US) 2015-03-03 US disclosed
US-8968868-B2 Curable-on-demand composition comprising dual reactive silane functionality 3M INNOVATIVE PROPERTIES COMPANY (US) 2015-03-03 US disclosed
US-20130178553-A1 CURABLE-ON-DEMAND COMPOSITION COMPRISING DUAL REACTIVE SILANE FUNCTIONALITY 3M INNOVATIVE PROPERTIES COMPANY (US) 2013-07-11 US disclosed
EP-2588536-A1 CURABLE-ON-DEMAND POLYSILOXANE COATING COMPOSITION 3M Innovative Properties Company (US) 2013-05-08 EP disclosed
EP-2588537-A1 CURABLE-ON-DEMAND COMPOSITION COMPRISING DUAL REACTIVE SILANE FUNCTIONALITY 3M Innovative Properties Company (US) 2013-05-08 EP disclosed
US-20130101841-A1 CURABLE-ON-DEMAND POLYSILOXANE COATING COMPOSITION 3M INNOVATIVE PROPERTIES COMPANY (US) 2013-04-25 US disclosed
WO-2012003153-A1 CURABLE-ON-DEMAND POLYSILOXANE COATING COMPOSITION 3M INNOVATIVE PROPERTIES COMPANY (US) 2012-01-05 WO disclosed
WO-2012003152-A1 CURABLE-ON-DEMAND COMPOSITION COMPRISING DUAL REACTIVE SILANE FUNCTIONALITY 3M INNOVATIVE PROPERTIES COMPANY (US) 2012-01-05 WO disclosed