SCHEMBL248792

SCHEMBL248792

O=C1CC=CC=CN1CCCNCc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ACHE P22303 6/20 0.49
MAOA P21397 1/20 0.46
CHRM2 P08172 1/20 0.45
SIGMAR1 Q99720 3/20 0.43
DPP7 Q9UHL4 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
TDP1 Q9NUW8 1/20 0.42

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
SCHEMBL29157597 0.75 HPGD (0.45) SIGMAR1MEN1KMT2A
SCHEMBL249046 0.73 MAOA (0.58) ACHEMAOACHRM2SIGMAR1DPP7
SCHEMBL248793 0.72 MAOA (0.45) ACHEMAOACHRM2SIGMAR1DPP7
SCHEMBL8541296 0.71 ACHE (0.88) ACHETDP1
SCHEMBL2444736 0.70 DPP7 (0.69) MAOACHRM2SIGMAR1DPP7MEN1
SCHEMBL28719274 0.69 MAOA (0.51) ACHEMAOACHRM2SIGMAR1DPP7
SCHEMBL4932707 0.68 MAOA (0.95) MAOACHRM2SIGMAR1MEN1KMT2A
SCHEMBL893154 0.68 MAOA (0.86) MAOACHRM2SIGMAR1MEN1KMT2A
SCHEMBL13327059 0.68 MEN1 (0.59) ACHEMAOACHRM2SIGMAR1DPP7
SCHEMBL14068417 0.68 CD274 (0.59) DPP7MEN1KMT2ATDP1

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