SCHEMBL24376323

SCHEMBL24376323

CNC(=O)c1ccc(-c2cc(C(N)=O)no2)cc1O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MLLT1 Q03111 4/20 0.49
MLLT3 P42568 3/20 0.49
ROCK2 O75116 1/20 0.47
PIM1 P11309 1/20 0.47
GSK3B P49841 1/20 0.47
MAPK1 P28482 1/20 0.44
NPC1 O15118 3/20 0.43
RAB9A P51151 3/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
HSD17B10 Q99714 2/20 0.43
KDM4E B2RXH2 2/20 0.43
MAPT P10636 1/20 0.43
TP53 P04637 2/20 0.42
HPGD P15428 1/20 0.41
ALDH1A1 P00352 4/20 0.41
NOTUM Q6P988 1/20 0.41
CYP1A2 P05177 1/20 0.41
LMNA P02545 1/20 0.41
HTT P42858 1/20 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
SCHEMBL24376314 0.82 MLLT3 (0.64) MLLT1MLLT3MAPK1NPC1RAB9A
SCHEMBL24376430 0.80 MLLT1 (0.71) MLLT1MLLT3ROCK2PIM1GSK3B
SCHEMBL21446983 0.79 ROCK2 (0.59) MLLT1MLLT3ROCK2PIM1GSK3B
SCHEMBL24376316 0.76 MLLT3 (0.49) MLLT1MLLT3MAPK1NPC1RAB9A
SCHEMBL6802996 0.73 TP53 (0.68) MLLT1ROCK2PIM1GSK3BNPC1
SCHEMBL926766 0.70 NEU3 (0.53) NPC1RAB9AMEN1KMT2AKDM4E
SCHEMBL19245571 0.70 ROCK2 (0.57) ROCK2PIM1GSK3BNPC1RAB9A
SCHEMBL24376591 0.69 MLLT3 (0.65) MLLT1MLLT3MAPK1NPC1RAB9A
SCHEMBL11275129 0.69 CDH1 (0.61) MAPK1NPC1RAB9AMAPTTP53
SCHEMBL2791692 0.69 RAB9A (0.60) NPC1RAB9AMEN1KMT2AMAPT

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
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