SCHEMBL25501121

SCHEMBL25501121

CCCCC(CCCCNC(=O)OC(C)(C)C)C(=O)O

nearest known ligand 0.79

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.79
KMT2A Q03164 3/20 0.79
GAA P10253 1/20 0.79
TDP1 Q9NUW8 1/20 0.55
CTSK P43235 7/20 0.49
CTSS P25774 2/20 0.49
MAOA P21397 1/20 0.49
MAOB P27338 1/20 0.49
CA2 P00918 3/20 0.47
MAPK1 P28482 1/20 0.47
CA12 O43570 2/20 0.47
CA1 P00915 2/20 0.47
CA9 Q16790 2/20 0.47
EPHX1 P07099 1/20 0.45
LMNA P02545 1/20 0.44
TSHR P16473 1/20 0.44
POLB P06746 1/20 0.42
MAPT P10636 1/20 0.42

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
SCHEMBL17150407 0.92 MEN1 (0.77) MEN1KMT2AGAATDP1CTSK
SCHEMBL26520283 0.90 MEN1 (0.72) MEN1KMT2AGAATDP1CTSK
SCHEMBL17079742 0.90 MEN1 (0.72) MEN1KMT2AGAATDP1CTSK
SCHEMBL25090844 0.89 MEN1 (0.88) MEN1KMT2AGAATDP1CTSK
SCHEMBL5749667 0.89 MEN1 (0.77) MEN1KMT2AGAATDP1CTSK
SCHEMBL18704730 0.89 MEN1 (0.77) MEN1KMT2AGAATDP1CTSK
SCHEMBL24117848 0.85 TDP1 (0.59) MEN1KMT2AGAATDP1CTSK
SCHEMBL17424026 0.85 MEN1 (0.57) MEN1KMT2AGAATDP1CTSK
SCHEMBL6200619 0.84 MEN1 (0.64) MEN1KMT2AGAATDP1CTSK
SCHEMBL6200616 0.84 MEN1 (0.64) MEN1KMT2AGAATDP1CTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023086399-A1 BIFUNCTIONAL DEGRADERS OF HEMATOPOIETIC PROGENITOR KINASE AND THERAPEUTIC USES THEREOF NURIX THERAPEUTICS, INC. (US) 2023-05-19 WO disclosed