SCHEMBL23728949

SCHEMBL23728949

Cn1cc(Nc2nc(C(N)CCNC(=O)OC(C)(C)C)cn2C)cc1C(=O)NCCC(N)c1cn(C)c(Nc2cc(C(=O)NCCC(N)c3cn(C)c(C(=O)O)n3)n(C)c2)n1

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.33
GAA P10253 1/20 0.33
KMT2A Q03164 1/20 0.33
MC4R P32245 1/20 0.32
TOP1 P11387 2/20 0.31
HRAS P01112 1/20 0.31
ESR1 P03372 1/20 0.31
ESR2 Q92731 1/20 0.31
KCNA5 P22460 1/20 0.31
KDM4E B2RXH2 1/20 0.31
POLB P06746 1/20 0.31
MAPT P10636 1/20 0.31
HIF1A Q16665 1/20 0.31
CSNK1D P48730 1/20 0.31

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
SCHEMBL23728911 1.00 MEN1 (0.33) MEN1GAAKMT2AMC4RTOP1
SCHEMBL23728900 0.94 MC4R (0.35) MEN1GAAKMT2AMC4RTOP1
SCHEMBL23728922 0.94 HDAC1 (0.32) TOP1HRASESR1ESR2KDM4E
SCHEMBL23728864 0.93 TOP1 (0.33) TOP1HRASESR1ESR2KDM4E
SCHEMBL23728934 0.91 KDM4E (0.33) MC4RKDM4EMAPT
SCHEMBL23728958 0.91 KDM4E (0.33) MC4RKDM4EMAPT
SCHEMBL23728968 0.90
SCHEMBL23728952 0.90 P2RX3 (0.35) MEN1GAAKMT2AMC4RTOP1
SCHEMBL23728955 0.89 TOP1 (0.35) MEN1GAAKMT2AMC4RTOP1
SCHEMBL23728901 0.88 TOP1 (0.33) MC4RTOP1HRASESR1ESR2

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
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