SCHEMBL715754

SCHEMBL715754

CCCCCCCCCCCCCON

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 1/20 0.77
ADRB1 P08588 1/20 0.77
ADRB3 P13945 1/20 0.77
TSHR P16473 2/20 0.50
THRB P10828 1/20 0.50
CA1 P00915 8/20 0.48
CA2 P00918 8/20 0.48
CA9 Q16790 7/20 0.48
CA12 O43570 3/20 0.48
CA7 P43166 3/20 0.48
CA14 Q9ULX7 3/20 0.48
CA3 P07451 2/20 0.48
CA4 P22748 2/20 0.48
CA6 P23280 2/20 0.48
CA5A P35218 2/20 0.48
CA5B Q9Y2D0 2/20 0.48
DNM1 Q05193 5/20 0.46
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
ALDH1A1 P00352 1/20 0.45

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
SCHEMBL741918 1.00 ADRB2 (0.77) ADRB2ADRB1ADRB3TSHRTHRB
SCHEMBL604618 1.00 ADRB2 (0.77) ADRB2ADRB1ADRB3TSHRTHRB
SCHEMBL19812451 1.00 ADRB2 (0.77) ADRB2ADRB1ADRB3TSHRTHRB
SCHEMBL6725430 1.00 ADRB2 (0.77) ADRB2ADRB1ADRB3TSHRTHRB
SCHEMBL8745178 1.00 ADRB2 (0.77) ADRB2ADRB1ADRB3TSHRTHRB
SCHEMBL605336 1.00 ADRB2 (0.77) ADRB2ADRB1ADRB3TSHRTHRB
SCHEMBL193964 1.00
SCHEMBL8617447 1.00 ADRB2 (0.77) ADRB2ADRB1ADRB3TSHRTHRB
SCHEMBL3075008 1.00 ADRB2 (0.77) ADRB2ADRB1ADRB3TSHRTHRB
SCHEMBL7518762 1.00 ADRB2 (0.77) ADRB2ADRB1ADRB3TSHRTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103958567-B Alkoxylate polyalkylene polyamine 巴斯夫欧洲公司 2016-10-12 CN disclosed
CN-105026538-A Aqueous formulations, their preparation and their use in the cleaning of hard surfaces BASF SE 2015-11-04 CN disclosed
CN-104159977-A Thermoplastic resin composition NIPPON NYUKAZAI CO LTD 2014-11-19 CN disclosed
CN-103958566-A Increase of molar mass of polyalkylene polyamines by homogeneously catalyzed alcohol amination BASF SE 2014-07-30 CN disclosed
CN-103958567-A Alkoxylated polyalkylene polyamines BASF SE 2014-07-30 CN disclosed
CN-103958568-A Preparation of lipophilic polyalkylene polyamines by homogeneously catalyzed alcohol amination BASF SE 2014-07-30 CN disclosed
US-20130116120-A1 ALKOXYLATED ALKYLAMINES/ALKYL ETHER AMINES WITH PEAKED DISTRIBUTION AKZO NOBEL N.V. (NL) 2013-05-09 US disclosed
US-8357636-B2 Alkoxylated alkylamines/alkyl ether amines with peaked distribution AKZO NOBEL N.V. (NL) 2013-01-22 US disclosed
US-20120053054-A1 ALKOXYLATED ALKYLAMINES/ALKYL ETHER AMINES WITH PEAKED DISTRIBUTION AKZO NOBEL N.V. (NL) 2012-03-01 US disclosed
US-8034979-B2 Reacting primary alkylamine with alkylene oxide in absence of any functional proportion of alkali catalyst to yield first intermediate followed by reacting intermediate with additional moles of alkylene oxide at temperature of 90-130 degrees C. in absence of alkali catalyst to yield ethoxylated product MONSANTO TECHNOLOGY LLC (US) 2011-10-11 US disclosed
US-20100056376-A1 ALKOXYLATED ALKYLAMINES/ALKYL ETHER AMINES WITH PEAKED DISTRIBUTION MONSANTO TECHNOLOGY LLC (US) 2010-03-04 US disclosed
WO-2007109791-A9 ALKOXYLATED ALKYLAMINES OR ALKYL ETHER AMINES WITH PEAKED DISTRIBUTION AKZO NOBEL NV (NL) 2009-01-15 WO disclosed
EP-2003965-A2 ALKOXYLATED ALKYLAMINES OR ALKYL ETHER AMINES WITH PEAKED DISTRIBUTION Akzo Nobel N.V. (NL) 2008-12-24 EP disclosed
US-20080261814-A1 Alkoxylated Alkylamines/Alkyl Ether Amines With Peaked Distribution MONSANTO TECHNOLOGY LLC (US) 2008-10-23 US disclosed
WO-2007109791-A2 ALKOXYLATED ALKYLAMINES OR ALKYL ETHER AMINES WITH PEAKED DISTRIBUTION AKZO NOBEL N.V. (NL) 2007-09-27 WO disclosed
EP-1793667-A1 ALKOXYLATED ALKYLAMINES / ALKYL ETHER AMINES WITH PEAKED DISTRIBUTION Akzo Nobel N.V. (NL) 2007-06-13 EP disclosed
WO-2006034459-A1 ALKOXYLATED ALKYLAMINES / ALKYL ETHER AMINES WITH PEAKED DISTRIBUTION AKZO NOBEL N.V. (NL) 2006-03-30 WO disclosed
US-4362552-A OXALIC ACID, AMINES, PEROXIDATION ETABLISSEMENTS HURET & FILS (BY CHANGE OF NAME NOW HURET & SES FILS) 60 AVENUE FELIX FAURE, NANTERRE (HAUTS DE SEINE), FRANCE, A FRENCH SOCIETY 1982-12-07 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20130116120-A1 ALKOXYLATED ALKYLAMINES/ALKYL ETHER AMINES WITH PEAKED DISTRIBUTION ALK, ALKBH3, NAT1 ADRB2 39/4885ADRB1 21/4885ADRB3 48/4885
US-20100056376-A1 ALKOXYLATED ALKYLAMINES/ALKYL ETHER AMINES WITH PEAKED DISTRIBUTION ALK, ALKBH3, NAT1 ADRB2 39/4885ADRB1 21/4885ADRB3 48/4885
US-20120053054-A1 ALKOXYLATED ALKYLAMINES/ALKYL ETHER AMINES WITH PEAKED DISTRIBUTION ALKBH3, ALKBH2, ALKBH1 ADRB2 108/4885ADRB1 65/4885ADRB3 124/4885
US-20080261814-A1 Alkoxylated Alkylamines/Alkyl Ether Amines With Peaked Distribution ALKBH3, ALKBH2, ALKBH1 ADRB2 108/4885ADRB1 65/4885ADRB3 124/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.