SCHEMBL7108954

SCHEMBL7108954

CN(CCCO)CCN(C)CCCO

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.44
CA2 P00918 1/20 0.44
CA3 P07451 1/20 0.44
CA4 P22748 1/20 0.44
CA6 P23280 1/20 0.44
CA5A P35218 1/20 0.44
CA7 P43166 1/20 0.44
CA9 Q16790 1/20 0.44
CA14 Q9ULX7 1/20 0.44
CA5B Q9Y2D0 1/20 0.44
MAPT P10636 3/20 0.42
CHRM2 P08172 2/20 0.41
ALDH1A1 P00352 3/20 0.37
LSS P48449 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
LMNA P02545 4/20 0.33
TSHR P16473 3/20 0.33
HTT P42858 2/20 0.33
HSD17B10 Q99714 1/20 0.33
S1PR2 O95136 1/20 0.33

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
SCHEMBL15287 0.97 MAPT (0.44) CA12CA2CA3CA4CA6
SCHEMBL26756027 0.93 MAPT (0.42) CA12CA2CA3CA4CA6
SCHEMBL11713630 0.93 MAPT (0.42) CA12CA2CA3CA4CA6
SCHEMBL3427086 0.91 CA12 (0.61) CA12CA2CA3CA4CA6
SCHEMBL21117178 0.91 CA12 (0.38) CA12CA2CA3CA4CA6
SCHEMBL3428918 0.90
SCHEMBL16105559 0.90 CHRM2 (0.46) CA12CA2CA3CA4CA6
SCHEMBL26756024 0.90 CHRM2 (0.52) CA12CA2CA3CA4CA6
Bromide SCHEMBL28007182 0.88 MAPT (0.45) CA12CA2CA3CA4CA6
SCHEMBL26493928 0.88 CHRM2 (0.50) MAPTCHRM2ALDH1A1LSSSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1092737-B1 Catalyst composition for the production of a polyurethane resin, and method for producing a polyurethane resin TOSOH CORP (JP) 2003-09-24 EP claimed
US-9617453-B2 Solvent free aqueous polyurethane dispersions and methods of making and using the same AIR PRODUCTS AND CHEMICALS, INC. (US) 2017-04-11 US disclosed
US-20110306724-A1 Solvent Free Aqueous Polyurethane Dispersions and Methods of Making and Using the Same AIR PRODUCTS AND CHEMICALS, INC. (US) 2011-12-15 US disclosed
US-20020055602-A1 Aromatic polyisocyanates blocked by pyrazole or pyrazole derivatives and the preparation and use thereof BAYER AKTIENGESELLSCHAFT (DE) 2002-05-09 US disclosed
EP-1184400-A1 Aromatic polyisocyanates blocked with pyrazole or pyrazole derivatives, process for their preparation and their use BAYER AG (DE) 2002-03-06 EP disclosed
US-5693737-A POLYETHERURETHANES FOR PREPARING CREASE-RESISTANT TEXTILES BAYER AKTIENGESELLSCHAFT (DE) 1997-12-02 US disclosed
US-5607482-A BLOCKED POLYISOCYANATE BAYER AKTIENGESELLSCHAFT (DE) 1997-03-04 US disclosed
EP-0449041-B1 Blends of cellulose and synthetic polymers, manufacture and uses thereof WOLFF WALSRODE AG (DE) 1996-09-11 EP disclosed
US-5508370-A POLYETHERURETHANE COPOLYMER; TEXTILE FINISH BAYER AKTIENGESELLSCHAFT (DE) 1996-04-16 US disclosed
EP-0703313-A1 Crosslinkers for textile printing binders BAYER AG (DE) 1996-03-27 EP disclosed
US-5166232-A CELLULOSE/PLASTIC BLENDS, A PROCESS FOR THEIR PRODUCTION AND THEIR USE WOLFF WALSRODE AKTIENGESELLSCHAFT (DE) 1992-11-24 US disclosed
EP-0449041-A2 Blends of cellulose and synthetic polymers, manufacture and uses thereof Wolff Walsrode Aktiengesellschaft (DE) 1991-10-02 EP disclosed
US-4544683-A GYPSUM-POLYURETHANE OR POLYURETHANE-POLYUREA BAYER AKTIENGESELLSCHAFT (DE) 1985-10-01 US disclosed
EP-0128399-A2 Support dressing and process for its manufacture BAYER AG (DE) 1984-12-19 EP disclosed
US-4324716-A -POLYURETHANE FOAMS BAYER AKTIENGESELLSCHAFT (DE) 1982-04-13 US disclosed
US-4310448-A POLYETHER OR POLYESTER DISPERSANTS FOR POLYURETHANES OR POLUREAS BAYER AKTIENGESELLSCHAFT (DE) 1982-01-12 US disclosed
US-4305858-A Process for the preparation of stable ionic dispersions of polyisocyanate-polyaddition products in hydroxyl containing compounds BAYER AKTIENGESELLSCHAFT (DE) 1981-12-15 US disclosed
US-4253886-A Corrosion resistant ferromagnetic metal powders and method of preparing the same FUJI PHOTO FILM CO., LTD. (JP) 1981-03-03 US disclosed
US-4147680-A Production of polyurethane resins using as active hydrogen material a stable dispersion of ionic polyisocyanate-polyaddition products in hydroxyl containing compounds as a dispersing agent BAYER AKTIENGESELLSCHAFT (DE) 1979-04-03 US disclosed
US-3970601-A COATINGS BAYER AKTIENGESELLSCHAFT (DT) 1976-07-20 US disclosed