SCHEMBL6324872

SCHEMBL6324872

Cc1cccc(-c2cc3ccccc3[nH]2)c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.67
RAB9A P51151 5/20 0.67
MEN1 O00255 5/20 0.58
KMT2A Q03164 5/20 0.58
KDM4E B2RXH2 5/20 0.58
MAPT P10636 5/20 0.58
ALDH1A1 P00352 4/20 0.58
HPGD P15428 4/20 0.58
HSD17B10 Q99714 2/20 0.58
SMN1; SMN2 Q16637 2/20 0.58
GFER P55789 1/20 0.58
POLB P06746 2/20 0.56
USP2 O75604 1/20 0.55
LMNA P02545 1/20 0.55
GAA P10253 1/20 0.55
ALOX15 P16050 1/20 0.55
TDP1 Q9NUW8 1/20 0.55
CASP3 P42574 2/20 0.54
SENP8 Q96LD8 2/20 0.54
SENP7 Q9BQF6 2/20 0.54

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
SCHEMBL29941469 1.00 NPC1 (0.67) NPC1RAB9AMEN1KMT2AKDM4E
SCHEMBL8304969 0.87 NPC1 (0.80) NPC1RAB9AMEN1KMT2AKDM4E
SCHEMBL8690359 0.85 RAB9A (0.66) NPC1RAB9AMEN1KMT2AKDM4E
SCHEMBL29804733 0.85 RAB9A (0.66) NPC1RAB9AMEN1KMT2AKDM4E
SCHEMBL28461746 0.81 NPC1 (0.78) NPC1RAB9AMEN1KMT2AKDM4E
SCHEMBL29804862 0.81 RAB9A (0.71) NPC1RAB9AMEN1KMT2AKDM4E
SCHEMBL3986163 0.81 RAB9A (0.71) NPC1RAB9AMEN1KMT2AKDM4E
2-Phenyl-1H-Indole SCHEMBL341378 0.81 NPC1 (1.00) NPC1RAB9AMEN1KMT2AKDM4E
2-Phenyl-1H-Indole SCHEMBL29363616 0.81 NPC1 (1.00) NPC1RAB9AMEN1KMT2AKDM4E
2-Phenyl-1H-Indole SCHEMBL6529483 0.79 NPC1 (0.96) NPC1RAB9AMEN1KMT2AKDM4E

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-115304533-B Bisindolemethane type alpha-glucosidase inhibitor and preparation method and application thereof 中国医学科学院药用植物研究所云南分所 2024-04-12 CN disclosed
CN-117567447-A Thiophene-containing bis-indolomethane type a-glucosidase inhibitor and preparation method and application thereof 中国医学科学院药用植物研究所云南分所 2024-02-20 CN disclosed
CN-115304533-A Bis-indole methane type alpha-glucosidase inhibitor and preparation method and application thereof 中国医学科学院药用植物研究所云南分所 2022-11-08 CN disclosed
CN-111087391-A 4-indole quinazoline compound and preparation method and application thereof 郑州大学 2020-05-01 CN disclosed
US-20190192691-A1 REGULATED BIOCIRCUIT SYSTEMS OBSIDIAN THERAPEUTICS, INC. 2019-06-27 US disclosed
US-6894079-B1 Method for reducing free-radical induced injury THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK 2005-05-17 US disclosed
WO-2000032181-A9 METHOD FOR REDUCING FREE-RADICAL INDUCED INJURY ROTTA ALEXANDRE T (US) 2002-04-11 WO disclosed
EP-1135114-A4 METHOD FOR REDUCING FREE-RADICAL INDUCED INJURY ROTTA ALEXANDRE T (US) 2002-01-02 EP disclosed
EP-1135114-A1 METHOD FOR REDUCING FREE-RADICAL INDUCED INJURY Rotta, Alexandre T. (US) 2001-09-26 EP disclosed
WO-2000032181-A1 METHOD FOR REDUCING FREE-RADICAL INDUCED INJURY ROTTA ALEXANDRE T (US) 2000-06-08 WO disclosed