SCHEMBL24376589

SCHEMBL24376589

COC(=O)c1cc(-c2ccc(C(=O)N(C)C)c(O)c2)on1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MLLT1 Q03111 3/20 0.64
MLLT3 P42568 2/20 0.64
NOTUM Q6P988 2/20 0.57
MAPK1 P28482 1/20 0.57
MAPT P10636 4/20 0.56
TP53 P04637 4/20 0.56
ALDH1A1 P00352 2/20 0.49
PPARG P37231 1/20 0.49
NCOA2 Q15596 1/20 0.49
NCOA1 Q15788 1/20 0.49
NCOA3 Q9Y6Q9 1/20 0.49
SMN1; SMN2 Q16637 2/20 0.46
HPGD P15428 3/20 0.42
RECQL P46063 1/20 0.42
KDM4E B2RXH2 1/20 0.41
HSD17B10 Q99714 1/20 0.41
NPC1 O15118 3/20 0.41
RAB9A P51151 2/20 0.41
LMNA P02545 1/20 0.41
MEN1 O00255 2/20 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
SCHEMBL24376591 0.86 MLLT3 (0.65) MLLT1MLLT3MAPK1MAPTTP53
SCHEMBL24376430 0.85 MLLT1 (0.71) MLLT1MLLT3MAPTTP53ALDH1A1
SCHEMBL24376314 0.85 MLLT3 (0.64) MLLT1MLLT3NOTUMMAPK1MAPT
SCHEMBL27101311 0.80 NOTUM (0.64) NOTUMMAPK1MAPTTP53ALDH1A1
SCHEMBL22778855 0.79 NOTUM (0.63) MLLT1NOTUMMAPK1MAPTTP53
SCHEMBL17731963 0.79 NOTUM (0.63) NOTUMMAPK1MAPTTP53ALDH1A1
SCHEMBL17731965 0.79 MAPK1 (0.80) NOTUMMAPK1MAPTTP53ALDH1A1
SCHEMBL29622224 0.78 MLLT3 (0.45) MLLT1MLLT3NOTUMMAPK1MAPT
SCHEMBL15498742 0.74 TP53 (0.75) NOTUMMAPK1MAPTTP53ALDH1A1
SCHEMBL5621967 0.74 NOTUM (0.67) MLLT1NOTUMMAPK1MAPTTP53

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-2022086937-A9 HETEROBIFUNCTIONAL COMPOUNDS AS DEGRADERS OF ENL ICAHN SCHOOL OF MEDICINE AT MOUNT SINAI (US) 2023-02-02 WO disclosed
WO-2022086937-A9 HETEROBIFUNCTIONAL COMPOUNDS AS DEGRADERS OF ENL ICAHN SCHOOL OF MEDICINE AT MOUNT SINAI (US) 2023-02-02 WO disclosed
WO-2022086937-A1 HETEROBIFUNCTIONAL COMPOUNDS AS DEGRADERS OF ENL ICAHN SCHOOL OF MEDICINE AT MOUNT SINAI (US) 2022-04-28 WO disclosed
WO-2022086937-A1 HETEROBIFUNCTIONAL COMPOUNDS AS DEGRADERS OF ENL ICAHN SCHOOL OF MEDICINE AT MOUNT SINAI (US) 2022-04-28 WO disclosed