SCHEMBL7601817

SCHEMBL7601817

COc1ccc2c(c1)c(C=O)c(C)n2C

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.64
KMT2A Q03164 4/20 0.64
NPC1 O15118 3/20 0.64
RAB9A P51151 1/20 0.64
MAPT P10636 7/20 0.54
KDM4E B2RXH2 4/20 0.54
GAA P10253 4/20 0.54
TDP1 Q9NUW8 2/20 0.54
ALDH1A1 P00352 5/20 0.51
HPGD P15428 3/20 0.51
L3MBTL1 Q9Y468 2/20 0.51
HTT P42858 2/20 0.51
HSD17B10 Q99714 1/20 0.51
PIK3CA P42336 1/20 0.51
MTOR P42345 1/20 0.51
PIK3CG P48736 1/20 0.51
NPSR1 Q6W5P4 3/20 0.50
BCHE P06276 2/20 0.50
ACHE P22303 2/20 0.50
MAPK1 P28482 1/20 0.50

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
SCHEMBL3409406 0.88 ALDH1A1 (0.54) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL29957009 0.83 MAPT (0.50) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL8081123 0.81 PTGER4 (0.64) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL1429516 0.80 PTGER4 (0.50) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL18271504 0.80 KDM4E (0.56) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL1429306 0.80 KDM4E (0.50) MEN1KMT2ANPC1RAB9AKDM4E
SCHEMBL7598707 0.80 POLB (0.55) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL25225487 0.80 KDM4E (0.50) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL12721222 0.79 FBP1 (0.48) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL7603198 0.79 ALDH1A1 (0.65) MEN1KMT2ANPC1RAB9AMAPT

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-2025056913-A1 COMPOUND AND METHOD OXFORD UNIVERSITY INNOVATION LIMITED (GB) 2025-03-20 WO disclosed
CN-113563336-B Evodiamine prodrug containing indoloquinone unit and preparation method and application thereof 陕西中医药大学 2022-12-06 CN disclosed
CN-113563336-A Evodiamine prodrug containing indoloquinone unit and preparation method and application thereof 陕西中医药大学 2021-10-29 CN disclosed
US-20160031812-A1 SEPIAPTERIN REDUCTASE INHIBITORS FOR THE TREATMENT OF PAIN SOLACE PHARMACEUTICALS UK LTD. (GB) 2016-02-04 US disclosed
US-20160031812-A1 SEPIAPTERIN REDUCTASE INHIBITORS FOR THE TREATMENT OF PAIN SOLACE PHARMACEUTICALS UK LTD. (GB) 2016-02-04 US disclosed
US-9169234-B2 Sepiapterin reductase inhibitors for the treatment of pain CHILDREN'S MEDICAL CENTER CORPORATION (US) 2015-10-27 US disclosed
US-9169234-B2 Sepiapterin reductase inhibitors for the treatment of pain CHILDREN'S MEDICAL CENTER CORPORATION (US) 2015-10-27 US disclosed
US-20120322800-A1 Sepiapterin Reductase Inhibitors For The Treatment of Pain SOLACE PHARMACEUTICALS UK LTD. (GB) 2012-12-20 US disclosed
US-20120322800-A1 Sepiapterin Reductase Inhibitors For The Treatment of Pain SOLACE PHARMACEUTICALS UK LTD. (GB) 2012-12-20 US disclosed
WO-2011047156-A1 SEPIAPTERIN REDUCTASE INHIBITORS FOR THE TREATMENT OF PAIN HERCULES TECHNOLOGY MANAGEMENT CO V, INC. (US) 2011-04-21 WO disclosed
US-7202265-B2 Indolinone combinatorial libraries and related products and methods for the treatment of disease SUGEN, INC. (US) 2007-04-10 US disclosed
US-7202265-B2 Indolinone combinatorial libraries and related products and methods for the treatment of disease SUGEN, INC. (US) 2007-04-10 US disclosed
EP-1264825-A1 Beta-Hydroxyalkylpicoliniumsalts Bayer Aktiengesellschaft (DE) 2002-12-11 EP disclosed
US-5840902-A REACTING PICOLINE WITH ALKYLENE OXIDE IN PRESENCE OF ACID IN WATER OR MIXTURE OF WATER AND POLAR SOLVENT BAYER AKTIENGESELLSCHAFT (DE) 1998-11-24 US disclosed
WO-1997023456-A1 INDOLOQUINONE DERIVATIVES AS BIOREDUCTIVE AGENTS BRITISH TECHNOLOGY GROUP LTD. (GB) 1997-07-03 WO disclosed
EP-0776888-A2 Process for the preparation of beta-Hydrosyalkylpicolinium salts and picolinium salts as intermediates for the prepation of cationic dyes BAYER AG (DE) 1997-06-04 EP disclosed
US-4513142-A Preparation of cationic methine dyestuffs BAYER AKTIENGESELLSCHAFT (DE) 1985-04-23 US disclosed
EP-0074569-A2 Cationic methine dyes, process for their preparation and their use, in dyeing textile materials and other substrates BAYER AG (DE) 1983-03-23 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20160031812-A1 SEPIAPTERIN REDUCTASE INHIBITORS FOR THE TREATMENT OF PAIN SPR, QDPR, SRR MEN1 4856/4885KMT2A 3756/4885NPC1 2778/4885
US-20120322800-A1 Sepiapterin Reductase Inhibitors For The Treatment of Pain SPR, QDPR, SRR MEN1 4856/4885KMT2A 3756/4885NPC1 2778/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.