SCHEMBL7213583

SCHEMBL7213583

O=C1C=Cc2ccc3cc4ccccc4cc3c2C1=O

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES1 P23141 6/20 0.72
ALDH1A1 P00352 4/20 0.40
PTPRC P08575 3/20 0.40
MEN1 O00255 2/20 0.40
LMNA P02545 2/20 0.40
HPGD P15428 2/20 0.40
KMT2A Q03164 2/20 0.40
HSD17B10 Q99714 2/20 0.40
KDM4E B2RXH2 2/20 0.40
BCHE P06276 1/20 0.40
POLB P06746 1/20 0.40
MAPT P10636 1/20 0.40
THRB P10828 1/20 0.40
PKM P14618 1/20 0.40
IDO1 P14902 1/20 0.40
ALOX15 P16050 1/20 0.40
PTPN1 P18031 1/20 0.40
ACHE P22303 1/20 0.40
RECQL P46063 1/20 0.40
PTPN22 Q9Y2R2 1/20 0.40

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
SCHEMBL87570 0.98 CES1 (0.70) CES1ALDH1A1PTPRCMEN1LMNA
SCHEMBL380656 0.84 CES1 (1.00) CES1ALDH1A1PTPRCMEN1LMNA
SCHEMBL29460197 0.79 CES1 (0.83) CES1ALDH1A1PTPRCMEN1LMNA
SCHEMBL2995536 0.77 CES1 (0.54) CES1ALDH1A1PTPRCMEN1LMNA
Furan SCHEMBL3095660 0.76 CES1 (0.81) CES1ALDH1A1PTPRCMEN1LMNA
SCHEMBL22609991 0.76 CES1 (0.81) CES1ALDH1A1PTPRCMEN1LMNA
SCHEMBL2957612 0.75 ALDH1A1 (0.64) CES1ALDH1A1MEN1LMNAHPGD
SCHEMBL29447251 0.75 ALDH1A1 (0.64) CES1ALDH1A1MEN1LMNAHPGD
Anthracene SCHEMBL28233789 0.73 CES1 (0.39) CES1ALDH1A1MEN1HPGDKMT2A
SCHEMBL5716919 0.72 CES1 (0.79) CES1ALDH1A1PTPRCMEN1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111557911-B A liposome of Tiancimycin, and its preparation method and application 哈药慈航制药股份有限公司 2022-08-05 CN disclosed
CN-111557911-A A liposome of Tiancimycin, and its preparation method and application 哈药慈航制药股份有限公司 2020-08-21 CN disclosed
CN-110383171-A Photosensitive resin composition for flexographic printing plate, flexographic printing original plate, flexographic printing plate and copolymer 旭化成株式会社 2019-10-25 CN disclosed
CN-106795275-B Actinic-radiation curable composition 株式会社钟化 2019-03-05 CN disclosed
CN-106164219-B Composite nanoparticle comprising thioether ligand 3M创新有限公司 2019-03-01 CN disclosed
CN-106164219-A Comprise the composite nanoparticle of thioether ligand 3M创新有限公司 2016-11-23 CN disclosed
US-6630280-B1 Resin and compound that generates an arylsulfonic acid when exposed to actinic radiation; sensitivity; resolution; smoothness FUJI PHOTO FILM CO., LTD. (JP) 2003-10-07 US disclosed
EP-0358452-B1 Visible radiation activated hydrosilation reaction MINNESOTA MINING & MFG (US) 1999-12-22 EP disclosed
EP-0358452-A2 Visible radiation activated hydrosilation reaction MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1990-03-14 EP disclosed
US-4626342-A QUINONE AND AMMONIUM, ALKALI METAL OR ALKALINE EARTH METAL AS CATALYST AIR PRODUCTS AND CHEMICALS, INC. (US) 1986-12-02 US disclosed