SCHEMBL1674606

SCHEMBL1674606

CCCCN(c1ccccc1)C(C)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.42
ALDH1A1 P00352 2/20 0.42
ADRB2 P07550 1/20 0.42
NPC1 O15118 1/20 0.41
JAK2 O60674 1/20 0.41
RAB9A P51151 1/20 0.41
PAX8 Q06710 1/20 0.41
TACR1 P25103 1/20 0.40
CNR2 P34972 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
TP53 P04637 1/20 0.40
NPSR1 Q6W5P4 2/20 0.38
GAA P10253 2/20 0.38
MAPT P10636 1/20 0.38
ALOX12 P18054 1/20 0.38
CRHBP P24387 1/20 0.38
HTT P42858 1/20 0.38
CRHR2 Q13324 1/20 0.38
ASAH1 Q13510 1/20 0.38
ACER2 Q5QJU3 1/20 0.38

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
Vinyl Ether SCHEMBL27592209 0.88 ALDH1A1 (0.36) ESR1ALDH1A1ADRB2NPC1JAK2
SCHEMBL13503172 0.85 TAAR1 (0.46) ESR1ALDH1A1ADRB2NPC1JAK2
SCHEMBL4358312 0.84 KCNH2 (0.36) ALDH1A1NPC1RAB9APAX8CNR2
SCHEMBL11787205 0.82 KMT2A (0.37) CNR2NPSR1MAPTKMT2A
SCHEMBL13183502 0.82 ALDH1A1 (0.40) ESR1ALDH1A1ADRB2NPC1JAK2
SCHEMBL11785353 0.82 TP53 (0.47) ALDH1A1NPC1RAB9APAX8CNR2
SCHEMBL11576636 0.81 NPC1 (0.41) ESR1ALDH1A1ADRB2NPC1JAK2
SCHEMBL30885596 0.81 KDM4E (0.49) ALDH1A1TP53MEN1KMT2ATAAR1
SCHEMBL3342836 0.81 ALDH1A1 (0.45) ESR1ALDH1A1ADRB2NPC1JAK2
SCHEMBL3342832 0.81 ALDH1A1 (0.45) ESR1ALDH1A1ADRB2NPC1JAK2

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
US-20220049039-A1 RADICAL POLYMERIZABLE RESIN COMPOSITION AND STRUCTURE REPAIRING MATERIAL SHOWA DENKO K.K. (JP) 2022-02-17 US disclosed
US-20210283655-A1 STRUCTURE REPAIRING METHOD SHOWA DENKO K.K. (JP) 2021-09-16 US disclosed
EP-3858805-A1 STRUCTURE REPAIRING METHOD Showa Denko K.K. (JP) 2021-08-04 EP disclosed
EP-3858880-A1 RADICAL POLYMERIZABLE RESIN COMPOSITION AND STRUCTURE REPAIRING MATERIAL Showa Denko K.K. (JP) 2021-08-04 EP disclosed
US-20210214471-A1 RADICALLY POLYMERIZABLE PUTTY-LIKE RESIN COMPOSITION, SEALING AGENT AND CRACK REPAIRING METHOD SHOWA DENKO K.K. (JP) 2021-07-15 US disclosed
EP-2308908-B1 Aqueous dispersion of a heat hardened polyurethane composition JANSEN BERNHARD (DE) 2014-06-25 EP disclosed
EP-2028202-B1 RADICAL POLYMERIZABLE RESIN COMPOSITION SHOWA DENKO KK (JP) 2012-10-31 EP disclosed
EP-2308908-A1 Aqueous dispersion of a heat hardened polyurethane composition Jansen, Bernhard (DE) 2011-04-13 EP disclosed
EP-2028202-A1 RADICAL POLYMERIZABLE RESIN COMPOSITION SHOWA HIGHPOLYMER CO., LTD. (JP) 2009-02-25 EP 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-0494157-B1 FLOTATION PROCESS FOR REMOVING FILLERS FROM WASTE PAPER IN THE PRESENCE OF POLYMERS AND COPOLYMERS HENKEL KGAA (DE) 1995-01-25 EP disclosed
EP-0494152-B1 USE OF AT LEAST PARTLY WATER-SOLUBLE POLYMERS FOR REMOVING PRINTING INK FROM PRINTED WASTE PAPER AND/OR RECYCLING WATER IN THE PAPERMAKING INDUSTRY HENKEL KGAA (DE) 1995-01-25 EP disclosed
EP-0537578-A2 Blocked polyisocyanate dispersable in water, process for its preparation and its use BAYER AG (DE) 1993-04-21 EP disclosed
EP-0494157-A1 FLOTATION PROCESS FOR REMOVING FILLERS FROM WASTE PAPER IN THE PRESENCE OF POLYMERS AND COPOLYMERS. HENKEL KGAA (DE) 1992-07-15 EP disclosed
EP-0446731-A2 Process for the manufacture of azo dyes BAYER AG (DE) 1991-09-18 EP disclosed
WO-1991003598-A1 USE OF AT LEAST PARTLY WATER-SOLUBLE POLYMERS FOR REMOVING PRINTING INK FROM PRINTED WASTE PAPER AND/OR RECYCLING WATER IN THE PAPERMAKING INDUSTRY HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1991-03-21 WO disclosed
WO-1991003597-A1 FLOTATION PROCESS FOR REMOVING FILLERS FROM WASTE PAPER IN THE PRESENCE OF POLYMERS AND COPOLYMERS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1991-03-21 WO disclosed
US-4217102-A Polyamides dyed with rubine disazo acid dyes and process therefore Toms River Chemical Company (US) 1980-08-12 US disclosed
US-4173565-A Rubine disazo acid dyes for polyamides TOMS RIVER CHEMICAL CORPORATION (US) 1979-11-06 US disclosed
US-4115413-A ACID FREE BAYER AKTIENGESELLSCHAFT (DE) 1978-09-19 US disclosed