SCHEMBL23728897

SCHEMBL23728897

CCOC(=O)c1nc(C(N)CCNC(=O)c2cc(Nc3nc(C(N)CCNC(=O)c4cc(Nc5nc(NC(=O)OC(C)(C)C)cn5C)cn4C)cn3C)cn2C)cn1C

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
RPS6KA3 P51812 1/20 0.33
P2RY12 Q9H244 1/20 0.33
HDAC1 Q13547 1/20 0.31
HDAC2 Q92769 1/20 0.31
HDAC8 Q9BY41 1/20 0.31
KDM4E B2RXH2 1/20 0.30
MAPT P10636 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30

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
SCHEMBL23728934 0.94 KDM4E (0.33) RPS6KA3P2RY12KDM4EMAPTNPSR1
SCHEMBL23728958 0.94 KDM4E (0.33) RPS6KA3P2RY12KDM4EMAPTNPSR1
SCHEMBL23728922 0.91 HDAC1 (0.32) HDAC1HDAC2HDAC8KDM4EMAPT
SCHEMBL23728963 0.90 P2RX3 (0.34) P2RY12HDAC1HDAC2HDAC8KDM4E
SCHEMBL23728940 0.89 P2RY12 (0.31) P2RY12
SCHEMBL23728901 0.89 TOP1 (0.33) HDAC1HDAC2HDAC8KDM4EMAPT
SCHEMBL23728911 0.85 MEN1 (0.33) KDM4EMAPT
SCHEMBL23728949 0.85 MEN1 (0.33) KDM4EMAPT
SCHEMBL23728909 0.84 RPS6KA3 (0.31) RPS6KA3P2RY12HDAC1HDAC2HDAC8
SCHEMBL23728952 0.83 P2RX3 (0.35) KDM4EMAPT

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
EP-4384506-A1 PROCESS FOR POLYAMIDE SYNTHESIS Design Therapeutics, Inc. (US) 2024-06-19 EP disclosed
WO-2023014793-A1 PROCESS FOR POLYAMIDE SYNTHESIS Design Therapeutics, Inc. (US) 2023-02-09 WO disclosed
EP-4100404-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE Design Therapeutics, Inc. (US) 2022-12-14 EP disclosed
WO-2021158707-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE Design Therapeutics, Inc. (US) 2021-08-12 WO disclosed