SCHEMBL5892000

SCHEMBL5892000

NC(=O)NC1C(N)C2CCN1CC2

nearest known ligand 0.31

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 1/20 0.31
SMYD3 Q9H7B4 1/20 0.30
MEN1 O00255 1/20 0.30
APEX1 P27695 1/20 0.30
KMT2A Q03164 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
LTA4H P09960 1/20 0.30

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
SCHEMBL277795 0.71 MEN1 (0.35) CHRNA7MEN1APEX1KMT2ATDP1
SCHEMBL28171897 0.65 POLB (0.44) MEN1KMT2ALTA4H
SCHEMBL5891936 0.65 ALDH1A1 (0.31) TDP1
Hydrochloric Acid SCHEMBL28280462 0.64 POLB (0.43) MEN1KMT2ALTA4H
SCHEMBL879026 0.64 CA12 (0.55) CHRNA7
SCHEMBL5892019 0.64 CA12 (0.55) CHRNA7
SCHEMBL28563561 0.63 CHRNA7 (0.39) CHRNA7
SCHEMBL28554134 0.63 CHRNA7 (0.39) CHRNA7
SCHEMBL28554136 0.63 CHRNA7 (0.39) CHRNA7
SCHEMBL22686540 0.63 SMYD3 (0.46) SMYD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1262500-B1 Catalyst for production of a polyurethane resin and method for producing a polyurethane resin TOSOH CORP (JP) 2015-12-30 EP disclosed
US-7064172-B2 Catalyst for production of a polyurethane resin and method for producing a polyurethane resin TOSOH CORPORATION (JP) 2006-06-20 US disclosed
US-20040147705-A1 Catalyst for production of a polyurethane resin and method for producting a polyurethane resin TOSOH CORPORATION (JP) 2004-07-29 US disclosed
US-6723819-B2 TERTIARY NITROGEN CATALYSTS THAT MAY BE AMINES, IMIDAZOLES, AND/OR UREAS TOSOH CORPORATION (JP) 2004-04-20 US disclosed
US-20030088046-A1 Catalyst for production of a polyurethane resin and method for producing a polyurethane resin TOSOH CORPORATION (JP) 2003-05-08 US disclosed
EP-1262500-A1 Catalyst for production of a polyurethane resin and method for producing a polyurethane resin Tosoh Corporation (JP) 2002-12-04 EP disclosed