SCHEMBL29438549

SCHEMBL29438549

Cc1c[nH]c(-c2cncnc2-c2ccc(Cl)cc2Cl)n1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.39
HSP90AA1 P07900 1/20 0.37
HSP90AB1 P08238 1/20 0.37
ROS1 P08922 1/20 0.36
CCNB2 O95067 1/20 0.36
CDK1 P06493 1/20 0.36
CCNB1 P14635 1/20 0.36
RPS6KB1 P23443 1/20 0.36
CDK2 P24941 1/20 0.36
GSK3A P49840 1/20 0.36
GSK3B P49841 1/20 0.36
LIMK1 P53667 1/20 0.36
TAOK1 Q7L7X3 1/20 0.36
CCNB3 Q8WWL7 1/20 0.36
SLK Q9H2G2 1/20 0.36
CLK4 Q9HAZ1 1/20 0.36
CSNK1G1 Q9HCP0 1/20 0.36
CRHR1 P34998 5/20 0.36
HSD11B1 P28845 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL27538173 0.81 MAP3K14 (0.48) HSP90AA1HSP90AB1ROS1CCNB2CDK1
SCHEMBL4975912 0.79 HSP90AA1 (0.36) HSP90AA1HSP90AB1CRHR1HSD11B1
SCHEMBL7029072 0.77 HSP90AA1 (0.45) HSP90AA1HSP90AB1CRHR1HSD11B1MAP3K14
SCHEMBL4814511 0.74 NPSR1 (0.59) NPSR1KMT2A
SCHEMBL3317224 0.73 ALDH1A1 (0.50) HSP90AA1HSP90AB1CRHR1HSD11B1
SCHEMBL952939 0.72 HSP90AA1 (0.37) HSP90AA1HSP90AB1CRHR1HSD11B1KMT2A
SCHEMBL31429725 0.72 IDO1 (0.41) NPSR1HSP90AA1HSP90AB1KMT2AKDM4E
SCHEMBL13257647 0.72 HSP90AA1 (0.36) HSP90AA1HSP90AB1CRHR1HSD11B1KMT2A
SCHEMBL23180940 0.70 GSK3B (0.57) ROS1CCNB2CDK1CCNB1RPS6KB1
SCHEMBL4404427 0.70 GSK3B (0.64) ROS1CCNB2CDK1CCNB1RPS6KB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024136442-A1 METHOD FOR PREPARING PANCREATIC ISLET ORGANOID USING STATIC SUSPENSION CULTURE METHOD 주식회사 강스템바이오텍 2024-06-27 WO claimed
EP-4662319-A2 PERSONALIZED CRISPR PROFILING FOR CANCER Integrate Bioscience LLC (US) 2025-12-17 EP disclosed
WO-2024168301-A2 PERSONALIZED CRISPR PROFILING FOR CANCER FUNCTION ONCOLOGY, INC. (US) 2024-08-15 WO disclosed
WO-2022037570-A1 EXPANSION CULTURE MEDIUM AND CULTURE METHOD FOR NEURAL CELLS 中国科学院动物研究所 2022-02-24 WO disclosed