SCHEMBL25423174

SCHEMBL25423174

COCCn1c(=O)c2cc(N)ccc2n(CCCN2CCOCC2)c1=O

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.45
▸ MEN1 O00255 3/20 0.45
▸ KMT2A Q03164 3/20 0.45
▸ KDM4E B2RXH2 4/20 0.44
▸ GLA P06280 4/20 0.44
▸ NPSR1 Q6W5P4 1/20 0.44
▸ MAPK1 P28482 2/20 0.44
▸ LMNA P02545 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ ABCB1 P08183 1/20 0.42
▸ GAA P10253 3/20 0.41
▸ PARG Q86W56 2/20 0.41
▸ HPGD P15428 2/20 0.41
▸ ADORA2B P29275 1/20 0.40
▸ HDAC1 Q13547 1/20 0.40

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
SCHEMBL30478139 1.00 ALDH1A1 (0.45) ALDH1A1MEN1KMT2AKDM4EGLA
SCHEMBL30478132 0.95 HDAC1 (0.44) ALDH1A1MEN1KMT2AKDM4EGLA
SCHEMBL25426033 0.95 HDAC1 (0.44) ALDH1A1MEN1KMT2AKDM4EGLA
SCHEMBL25724384 0.91 PARG (0.43) ALDH1A1MEN1KMT2AKDM4EABCB1
SCHEMBL30478129 0.90 PARG (0.43) ALDH1A1MEN1KMT2AKDM4EABCB1
SCHEMBL25423746 0.90 PARG (0.43) ALDH1A1MEN1KMT2AKDM4EABCB1
SCHEMBL25724415 0.90 PARG (0.43) ALDH1A1MEN1KMT2AABCB1PARG
SCHEMBL25724548 0.86 KDM4E (0.46) ALDH1A1MEN1KMT2AKDM4ENPSR1
SCHEMBL25439300 0.86 PARG (0.46) ALDH1A1MEN1KMT2AKDM4EGAA
SCHEMBL30478144 0.85 PARG (0.46) ALDH1A1KDM4EGLAGAAPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023119320-A1 A PREPARATION OF QUINAZOLINEDIONES AND USE THEREOF COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH AN INDIAN REGISTERED BODY INCORPORATED UNDER THE REGN. OF SOC. ACT (ACT XXI OF 1860) (IN) 2023-06-29 — — WO disclosed
WO-2023119320-A1 A PREPARATION OF QUINAZOLINEDIONES AND USE THEREOF COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH AN INDIAN REGISTERED BODY INCORPORATED UNDER THE REGN. OF SOC. ACT (ACT XXI OF 1860) (IN) 2023-06-29 — — WO disclosed
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