SCHEMBL260807

SCHEMBL260807

CNCC(=O)c1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.62
HPGD P15428 4/20 0.62
SMN1; SMN2 Q16637 4/20 0.62
MEN1 O00255 3/20 0.62
CYP3A4 P08684 3/20 0.62
MAPT P10636 3/20 0.62
MAPK1 P28482 2/20 0.62
KDM4E B2RXH2 2/20 0.62
TDP1 Q9NUW8 2/20 0.62
ALOX15 P16050 1/20 0.62
CES1 P23141 1/20 0.62
RAB9A P51151 3/20 0.55
NPC1 O15118 2/20 0.55
PTPN1 P18031 2/20 0.54
ERCC5 P28715 1/20 0.54
FEN1 P39748 1/20 0.54
ALDH1A1 P00352 7/20 0.52
GSK3B P49841 2/20 0.52
HIF1A Q16665 2/20 0.52
TRPA1 O75762 1/20 0.52

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
Hydrochloric Acid SCHEMBL259354 0.98 KMT2A (0.60) KMT2AHPGDSMN1; SMN2MEN1CYP3A4
SCHEMBL13290372 0.82 KMT2A (0.52) KMT2AHPGDSMN1; SMN2MEN1CYP3A4
SCHEMBL5932634 0.81 HPGD (0.68) KMT2AHPGDSMN1; SMN2MEN1CYP3A4
SCHEMBL29071120 0.80 HSD17B3 (0.55) HPGDCYP3A4MAPTKDM4ETDP1
SCHEMBL22876929 0.80 NPC1 (0.59) KMT2AHPGDSMN1; SMN2MEN1CYP3A4
Hydrochloric Acid SCHEMBL9432569 0.79 HPGD (0.65) KMT2AHPGDSMN1; SMN2MEN1CYP3A4
SCHEMBL6899907 0.79 MEN1 (0.65) KMT2AHPGDSMN1; SMN2MEN1CYP3A4
Bromide SCHEMBL10777716 0.79 HPGD (0.65) KMT2AHPGDSMN1; SMN2MEN1CYP3A4
SCHEMBL6046322 0.78 KMT2A (0.58) KMT2AHPGDSMN1; SMN2MEN1CYP3A4
SCHEMBL1945591 0.78 MTNR1A (0.59) KMT2AHPGDSMN1; SMN2MEN1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2017077550-A1 A METAL FREE PROCESS FOR THE PREPARATION OF ALPHA-SUBSTITUTED CARBONYL COMPOUNDS FROM ALKENES COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2017-05-11 WO claimed
EP-2661436-B1 NOVEL SULFAMIDE PIPERAZINE DERIVATIVES AS PROTEIN TYROSINE KINASE INHIBITORS AND PHARMACEUTICAL USE THEREOF LEO PHARMA AS (DK) 2016-04-13 EP claimed
WO-2005016883-A2 ACRYLAMIDE DERIVATIVES AS VLA-1 INTEGRIN ANTAGONISTS AND USES THEREOF ICOS CORPORATION (US) 2005-02-24 WO claimed
US-4132436-A Recording material FUJI PHOTO FILM CO., LTD. (JP) 1979-01-02 US claimed
US-4119777-A BY OXIDATION OF A THIOAMIDE DERIVATIVE FUJI PHOTO FILM CO., LTD. (JP) 1978-10-10 US claimed
WO-2024090369-A1 COMPOUND, COMPOSITION, CURED PRODUCT, METHOD FOR PRODUCING CURED PRODUCT, AND METHOD FOR PRODUCING ELECTRONIC COMPONENT 株式会社ADEKA 2024-05-02 WO disclosed
US-20230367049-A1 COLORED COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2023-11-16 US disclosed
US-20230357538-A1 RESIN COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2023-11-09 US disclosed
CN-110831586-B Dimethyl-nonyltetraalkenyl-trimethyl-cyclohexyl compounds and uses thereof 密执安大学评议会 2023-06-13 CN disclosed
WO-2023101556-A1 NOVEL INHIBITORS OF ASPARTATE TRANSCARBAMOYLASE (ATCASE) AND COMPOSITIONS, METHODS AND USES RELATED THERETO. RIJKSUNIVERSITEIT GRONINGEN (NL) 2023-06-08 WO disclosed
CN-115385782-A Mechanochemical synthesis method of benzoyl compound 兰州大学 2022-11-25 CN disclosed
EP-3601232-B1 COMPOSITIONS AND METHODS COMPRISING SUBSTITUTED 2-AMINOIMIDAZOLES CURZA GLOBAL LLC (US) 2022-11-23 EP disclosed
US-4119777-A BY OXIDATION OF A THIOAMIDE DERIVATIVE FUJI PHOTO FILM CO., LTD. (JP) 1978-10-10 US disclosed
US-4105518-A POLYMER CONTAINING ACRYLYL, ACRYLAMIDE OR ALLYL UNSATURATED GROUPS, REACTED WITH SECONDARY AMINE AND NEUTRALIZED, SENSITIZER SCM CORPORATION (US) 1978-08-08 US disclosed
US-4052280-A PHOTOSENTIZER IN BACKBONE OF POLYMER SCM CORPORATION (US) 1977-10-04 US disclosed
US-4051308-A Process for polymerizing butadiene with cobalt complex, AlR3 and CS2 THE FIRESTONE TIRE & RUBBER COMPANY (US) 1977-09-27 US disclosed
US-4040925-A PAINTS; CHEMICALLY BONDED ULTRAVIOLET SENSITIZER SCM CORPORATION (US) 1977-08-09 US disclosed
US-4039414-A ACRYLYL, ACRYLAMIDE, OR ALLYL POLYMERS, BENZALDEHYDE SENSITIZER SCM CORPORATION (US) 1977-08-02 US disclosed
US-3993856-A CATALYST OF COBALT COMPOUND, HYDRO- OR HYDROCARBYLALUMINUM DIHALIDE, AND CARBON DISULFIDE THE FIRESTONE TIRE & RUBBER COMPANY (US) 1976-11-23 US disclosed
US-3956390-A Preparation of amines SCHERING CORPORATION (US) 1976-05-11 US disclosed