SCHEMBL4614745

SCHEMBL4614745

CN(C)CCN(OCCO)OCCO

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.46
CA12 O43570 2/20 0.35
CA2 P00918 2/20 0.35
CA9 Q16790 2/20 0.35
CA3 P07451 1/20 0.35
CA4 P22748 1/20 0.35
CA6 P23280 1/20 0.35
CA5A P35218 1/20 0.35
CA7 P43166 1/20 0.35
CA14 Q9ULX7 1/20 0.35
CA5B Q9Y2D0 1/20 0.35
CHRM2 P08172 1/20 0.33
CHRM4 P08173 1/20 0.33
CHRM5 P08912 1/20 0.33
CHRM1 P11229 1/20 0.33
CHRNB2 P17787 1/20 0.33
CHRM3 P20309 1/20 0.33
CHRNA4 P43681 1/20 0.33
CA1 P00915 1/20 0.32
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL6232031 0.87 TSHR (0.39) ALDH1A1TSHRMAPK1
SCHEMBL23671358 0.86 MAPT (0.42) MAPTCA12CA2CA9CHRM2
SCHEMBL4130583 0.78 TSHR (0.37) MAPTALDH1A1TSHRMAPK1
Trimethylammonium SCHEMBL10711048 0.78 TSHR (0.36) MAPTALDH1A1TSHR
SCHEMBL97472 0.77 TSHR (0.39) MAPTALDH1A1TSHRMAPK1
SCHEMBL346950 0.77 TSHR (0.32) TSHRMAPK1
SCHEMBL5406204 0.75 PIK3CD (0.33) ALDH1A1TSHRMAPK1
Ammonia Solution, Strong SCHEMBL8059836 0.75 TSHR (0.37) MAPTALDH1A1TSHRMAPK1
SCHEMBL18700539 0.75
SCHEMBL11640522 0.74 TSHR (0.33) TSHRMAPK1

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 30 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0410467-B1 Process for producing high resilience Polyurethane foam TOSOH CORP (JP) 1996-12-18 EP claimed
EP-0410467-A2 Process for producing high resilience Polyurethane foam Tosoh Corporation (JP) 1991-01-30 EP claimed
EP-1440109-B1 OPTICAL BRIGHTENERS, THEIR COMPOSITION, THEIR PRODUCTION AND THEIR USE CLARIANT FINANCE BVI LTD (VG) 2008-01-30 EP disclosed
US-7060201-B2 Mixture of cationic polymer, white pigments or filler and water; paper substrate for ink jet printing CLARIANT FINANCE (BVI) LIMITED (VG) 2006-06-13 US disclosed
US-7019134-B2 Amphoteric optical brighteners, their aqueous solutions, their production and their use CLARIANT FINANCE (BVI) LIMITED (VG) 2006-03-28 US disclosed
US-6911116-B2 Cationically modified white pigments, their production and use CLARIANT FINANCE (BVI) LIMITED (VG) 2005-06-28 US disclosed
EP-0974568-B1 Process for the encapsulation of fertilizers with a symmetrical polyureaurethane composition BAYER AG (US) 2005-04-20 EP disclosed
US-20040237846-A1 Optical brighteners their composition their production and their use CLARIANT FINANCE (BVI) LIMITED (VG) 2004-12-02 US disclosed
EP-1242392-B1 AMPHOTERIC OPTICAL BRIGHTENERS, THEIR AQUEOUS SOLUTIONS, THEIR PRODUCTION AND THEIR USE CLARIANT FINANCE BVI LTD (VG) 2004-05-06 EP disclosed
EP-1093538-B1 POLYCATIONIC POLYMERS, THEIR PRODUCTION AND USE CLARIANT FINANCE BVI LTD (VG) 2003-09-17 EP disclosed
EP-1250385-B1 CATIONICALLY MODIFIED WHITE PIGMENTS, THEIR PRODUCTION AND USE CLARIANT FINANCE BVI LTD (VG) 2003-07-02 EP disclosed
WO-2001046161-A1 AMPHOTERIC OPTICAL BRIGHTENERS, THEIR AQUEOUS SOLUTIONS, THEIR PRODUCTION AND THEIR USE CLARIANT FINANCE (BVI) LIMITED (VG) 2001-06-28 WO disclosed
EP-1093538-A1 POLYCATIONIC POLYMERS, THEIR PRODUCTION AND USE Clariant Finance (BVI) Limited (VG) 2001-04-25 EP disclosed
US-6165550-A Symmetrical Polyurea-urethane fertilizer encapsulation BAYER CORPORATION (US) 2000-12-26 US disclosed
EP-0974568-A2 Symmetrical polyureaurethane fertilizer encapsulation Bayer Corporation (US) 2000-01-26 EP disclosed
WO-1999067463-A1 POLYCATIONIC POLYMERS, THEIR PRODUCTION AND USE CLARIANT FINANCE (BVI) LIMITED (VG) 1999-12-29 WO disclosed
WO-1999067317-A1 POLYCATIONIC POLYMER SALTS, THEIR PRODUCTION AND USE CLARIANT FINANCE (BVI) LIMITED (VG) 1999-12-29 WO disclosed
EP-0410467-B1 Process for producing high resilience Polyurethane foam TOSOH CORP (JP) 1996-12-18 EP disclosed
US-5104907-A Amine type catalyst and water as blowing agent TOSOH CORPORATION (JP) 1992-04-14 US disclosed
EP-0410467-A2 Process for producing high resilience Polyurethane foam Tosoh Corporation (JP) 1991-01-30 EP disclosed