SCHEMBL11032133

SCHEMBL11032133

NCCCCNCC=Cc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PRMT1 Q99873 1/20 0.50
RAB9A P51151 1/20 0.43
KDM4E B2RXH2 1/20 0.42
IDO1 P14902 2/20 0.42
ALDH1A1 P00352 1/20 0.41
S1PR1 P21453 3/20 0.41
S1PR3 Q99500 2/20 0.41
PAOX Q6QHF9 1/20 0.41

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
SCHEMBL29176161 1.00 PRMT1 (0.50) PRMT1RAB9AKDM4EIDO1ALDH1A1
SCHEMBL28520466 0.98 PRMT1 (0.49) PRMT1RAB9AKDM4EIDO1ALDH1A1
SCHEMBL30694747 0.98 PRMT1 (0.49) PRMT1RAB9AKDM4EIDO1ALDH1A1
SCHEMBL4948645 0.91 PRMT1 (0.54) PRMT1RAB9AKDM4EIDO1ALDH1A1
SCHEMBL28725423 0.91 PRMT1 (0.54) PRMT1RAB9AKDM4EIDO1ALDH1A1
SCHEMBL11031807 0.83 HDAC3 (0.45) IDO1
SCHEMBL11023328 0.83 ESR1 (0.40) KDM4EALDH1A1S1PR1S1PR3PAOX
SCHEMBL11597360 0.83 PRMT1 (0.55) PRMT1RAB9AKDM4EIDO1ALDH1A1
SCHEMBL11597357 0.83 PRMT1 (0.55) PRMT1RAB9AKDM4EIDO1ALDH1A1
SCHEMBL11033807 0.83 EGFR (0.51) PRMT1RAB9AKDM4EALDH1A1S1PR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114657238-B Medlar 40K liquid phase chip and application 宁夏农林科学院枸杞科学研究所 2023-03-24 CN claimed
CN-114657238-A Medlar 40K liquid phase chip and application 宁夏农林科学院枸杞科学研究所 2022-06-24 CN claimed
EP-0052330-B1 NOVEL RESIN COMPOSITION, COATING MATERIAL COMPRISING SAID RESIN COMPOSITION AND METHOD FOR FORMING COATINGS Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1984-09-05 EP claimed
US-4447580-A POLYMER CONSISTING OF UNSATD AROMATIC AMINE AND UNSATURATED COMPOUND WITH ELECTRON ATTRACTIVE GROUP ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1984-05-08 US claimed
EP-0052330-A1 Novel resin composition, coating material comprising said resin composition and method for forming coatings Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1982-05-26 EP claimed
CN-114594171-B Metabolome deep annotation method 中国科学院大连化学物理研究所 2023-12-15 CN disclosed
CN-114657238-B Medlar 40K liquid phase chip and application 宁夏农林科学院枸杞科学研究所 2023-03-24 CN disclosed
CN-114657238-A Medlar 40K liquid phase chip and application 宁夏农林科学院枸杞科学研究所 2022-06-24 CN disclosed
EP-0052330-B1 NOVEL RESIN COMPOSITION, COATING MATERIAL COMPRISING SAID RESIN COMPOSITION AND METHOD FOR FORMING COATINGS Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1984-09-05 EP disclosed
US-4447580-A POLYMER CONSISTING OF UNSATD AROMATIC AMINE AND UNSATURATED COMPOUND WITH ELECTRON ATTRACTIVE GROUP ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1984-05-08 US disclosed
EP-0052330-A1 Novel resin composition, coating material comprising said resin composition and method for forming coatings Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1982-05-26 EP disclosed