SCHEMBL26310974

SCHEMBL26310974

CCC1Oc2ccc(CCl)cc2NC1=O

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 2/20 0.53
MAPK1 P28482 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.47
TP53 P04637 1/20 0.46
POLB P06746 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
USP2 O75604 1/20 0.45
GAA P10253 1/20 0.45
HSD17B10 Q99714 2/20 0.45
TSHR P16473 1/20 0.43
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
ALOX15 P16050 2/20 0.42
THRB P10828 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
SCHEMBL26311050 0.86 L3MBTL1 (0.53) PARP1MAPK1L3MBTL1TP53POLB
SCHEMBL26310973 0.83 PARP1 (0.49) PARP1MAPK1L3MBTL1TP53POLB
SCHEMBL11831795 0.82 HSD17B10 (0.61) PARP1MAPK1L3MBTL1TP53POLB
SCHEMBL6997788 0.82 PARP1 (0.64) PARP1MAPK1TP53POLBSMN1; SMN2
SCHEMBL3077917 0.81 MAPK1 (0.49) PARP1MAPK1L3MBTL1TP53POLB
SCHEMBL23571859 0.81 USP2 (0.65) TP53USP2GAAHSD17B10TSHR
SCHEMBL29823082 0.81 USP2 (0.65) TP53USP2GAAHSD17B10TSHR
SCHEMBL23534259 0.79 L3MBTL1 (0.49) PARP1MAPK1L3MBTL1TP53USP2
SCHEMBL7003159 0.79 PARP1 (0.74) PARP1MAPK1L3MBTL1TP53POLB
SCHEMBL532921 0.77 USP2 (0.48) PARP1MAPK1L3MBTL1TP53USP2

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-2023178035-A1 MULTICYCLIC COMPOUNDS SLAP PHARMACEUTICALS LLC (US) 2023-09-21 WO disclosed