SCHEMBL5040570

SCHEMBL5040570

c1ccc(CNCCNCCNCCNCCNCc2ccccc2)cc1

nearest known ligand 0.94

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.94
▸ KMT2A Q03164 1/20 0.94
▸ TDP1 Q9NUW8 1/20 0.94
▸ CHRM2 P08172 1/20 0.77
▸ MAOA P21397 1/20 0.73
▸ GAA P10253 1/20 0.70
▸ MAPT P10636 1/20 0.70
▸ SIGMAR1 Q99720 4/20 0.64
▸ DRD4 P21917 1/20 0.59
▸ SMN1; SMN2 Q16637 1/20 0.59
▸ MPO P05164 2/20 0.55
▸ DPP7 Q9UHL4 1/20 0.55
▸ IDO1 P14902 2/20 0.52
▸ THRB P10828 1/20 0.52
▸ ADH1B P00325 1/20 0.52
▸ ADH1C P00326 1/20 0.52
▸ ADH1A P07327 1/20 0.52
▸ ADH7 P40394 1/20 0.52

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
SCHEMBL4913828 1.00 MEN1 (0.94) MEN1KMT2ATDP1CHRM2MAOA
SCHEMBL4922899 1.00 MEN1 (0.94) MEN1KMT2ATDP1CHRM2MAOA
SCHEMBL5764 0.97 MEN1 (1.00) MEN1KMT2ATDP1CHRM2MAOA
Hydrochloric Acid SCHEMBL5845845 0.94 MEN1 (0.94) MEN1KMT2ATDP1CHRM2MAOA
Ammonia Solution, Strong SCHEMBL6678345 0.94 MEN1 (0.94) MEN1KMT2ATDP1CHRM2MAOA
Hydrochloric Acid SCHEMBL11324591 0.94 MEN1 (0.94) MEN1KMT2ATDP1CHRM2MAOA
SCHEMBL4969293 0.94 MEN1 (0.94) MEN1KMT2ATDP1CHRM2MAOA
Water SCHEMBL4230715 0.94 MEN1 (0.94) MEN1KMT2ATDP1CHRM2MAOA
SCHEMBL12523231 0.93 CHRM2 (0.83) MEN1KMT2ATDP1CHRM2MAOA
SCHEMBL12523232 0.93 CHRM2 (0.83) MEN1KMT2ATDP1CHRM2MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1914254-B1 Crosslinkers for improving stability of polyurethane foams EVONIK DEGUSSA GMBH (DE) 2017-08-23 — — EP claimed
EP-1914254-A1 Crosslinkers for improving stability of polyurethane foams Air Products and Chemicals, Inc. (US) 2008-04-23 — — EP claimed
EP-1914254-B1 Crosslinkers for improving stability of polyurethane foams EVONIK DEGUSSA GMBH (DE) 2017-08-23 — — EP disclosed
US-8513376-B2 Polyamides and amidoamines from selectively modified amine amines AIR PRODUCTS AND CHEMICALS, INC. (US) 2013-08-20 — — US disclosed
US-20120237774-A1 Polyamides and Amidoamines From Selectively Modified Amine Amines AIR PRODUCTS AND CHEMICALS, INC. (US) 2012-09-20 — — US disclosed
WO-2012125240-A2 POLYAMIDES AND AMIDOAMINES FROM SELECTIVELY MODIFIED AMINE AMINES AIR PRODUCTS AND CHEMICALS, INC. (US) 2012-09-20 — — WO disclosed
EP-1914254-A1 Crosslinkers for improving stability of polyurethane foams Air Products and Chemicals, Inc. (US) 2008-04-23 — — EP disclosed
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