SCHEMBL6694230

SCHEMBL6694230

O=NN(c1ccccc1)C1CCCCC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.47
ALDH1A1 P00352 3/20 0.47
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
KDM4E B2RXH2 3/20 0.47
NPC1 O15118 1/20 0.47
MITF O75030 1/20 0.47
RAB9A P51151 1/20 0.47
PAX8 Q06710 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
ALOX15 P16050 1/20 0.45
KCNA3 P22001 1/20 0.44
TRPM8 Q7Z2W7 2/20 0.44
HPGD P15428 2/20 0.40
ATM Q13315 1/20 0.40
USP2 O75604 1/20 0.40
HSD17B10 Q99714 1/20 0.40
PKM P14618 1/20 0.40
CYP3A4 P08684 1/20 0.40
G6PC1 P35575 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
SCHEMBL9878434 0.90 MEN1 (0.39) ESR1ALDH1A1MEN1KMT2AKDM4E
SCHEMBL10793012 0.89 MCL1 (0.43) ESR1ALDH1A1MEN1KMT2AKDM4E
SCHEMBL10792506 0.81 CNR1 (0.44) ALDH1A1MEN1KMT2AKDM4ENPC1
SCHEMBL10791610 0.81 CYP2C9 (0.41) ALDH1A1MEN1KMT2AKDM4ENPC1
SCHEMBL10794053 0.80 NPSR1 (0.50) ALDH1A1MEN1KMT2AKDM4ENPC1
SCHEMBL616634 0.79 KCNA3 (0.53) ESR1ALDH1A1MEN1KMT2AKDM4E
SCHEMBL10792968 0.78 ALDH1A1 (0.39) ALDH1A1MEN1KMT2ANPC1RAB9A
SCHEMBL8535000 0.78 HTR2A (0.54) KDM4EPKML3MBTL1
SCHEMBL10797513 0.78 NR1H3 (0.41) MEN1KMT2ARAB9ASMN1; SMN2HPGD
SCHEMBL11484964 0.77 KCNA3 (0.51) ESR1ALDH1A1MEN1KMT2AKDM4E

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
WO-2020040052-A1 CURABLE RESIN COMPOSITION AND CURED PRODUCT THEREFROM 昭和電工株式会社 2020-02-27 WO claimed
US-10072164-B2 Active energy ray-curable inkjet ink composition and printed product DNP FINE CHEMICALS CO., LTD. (JP) 2018-09-11 US claimed
US-20170009089-A1 ACTIVE ENERGY RAY-CURABLE INKJET INK COMPOSITION AND PRINTED PRODUCT DNP FINE CHEMICALS CO LTD (JP) 2017-01-12 US claimed
JP-59164733-A None JP disclosed
JP-59164735-A None JP disclosed
CN-110526855-B Preparation method of 3-nitroso substituted indole derivative 郑州大学 2020-11-27 CN disclosed
WO-2020040052-A1 CURABLE RESIN COMPOSITION AND CURED PRODUCT THEREFROM 昭和電工株式会社 2020-02-27 WO disclosed
WO-2020040052-A1 CURABLE RESIN COMPOSITION AND CURED PRODUCT THEREFROM 昭和電工株式会社 2020-02-27 WO disclosed
EP-2821447-B1 PIGMENT DISPERSION LIQUID FOR INKJET INKS, ACTIVE ENERGY BEAM-CURABLE INKJET INK, AND PRINT DNP FINE CHEMICALS CO LTD (JP) 2018-10-31 EP disclosed
US-10072164-B2 Active energy ray-curable inkjet ink composition and printed product DNP FINE CHEMICALS CO., LTD. (JP) 2018-09-11 US disclosed
US-20170009089-A1 ACTIVE ENERGY RAY-CURABLE INKJET INK COMPOSITION AND PRINTED PRODUCT DNP FINE CHEMICALS CO LTD (JP) 2017-01-12 US disclosed
US-9487665-B2 Pigment dispersion liquid for inkjet ink, active energy ray-curable inkjet ink composition, and printed product DNP FINE CHEMICALS CO., LTD. (JP) 2016-11-08 US disclosed
US-20150030825-A1 PIGMENT DISPERSION LIQUID FOR INKJET INK, ACTIVE ENERGY BEAM-CURABLE INKJET INK, AND PRINTED PRODUCT DNP FINE CHEMICALS CO., LTD. (JP) 2015-01-29 US disclosed
EP-2821447-A1 PIGMENT DISPERSION LIQUID FOR INKJET INKS, ACTIVE ENERGY BEAM-CURABLE INKJET INK, AND PRINT DNP Fine Chemicals Co., Ltd. (JP) 2015-01-07 EP disclosed
JP-2004263103-A POLYMERIZATION INHIBITOR OF AROMATIC VINYL COMPOUND, AND POLYMERIZATION-INHIBITING METHOD HAKUTO CO LTD 2004-09-24 JP disclosed
JP-S59164733-A PRODUCTION OF 2,3-DICHLOROBUTADIENE-1,3 TOYO SODA MFG CO LTD 1984-09-17 JP disclosed
JP-S59164735-A 2,3-DICHLOROBUTADIENE-1,3 COMPOSITION HAVING IMPROVED STORAGE STABILITY TOYO SODA MFG CO LTD 1984-09-17 JP disclosed
US-4258059-A Amino-benzamides USV PHARMACEUTICAL CORPORATION (US) 1981-03-24 US disclosed