SCHEMBL30318924

SCHEMBL30318924

CC(=O)Nc1cccc(N=C=O)c1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.56
ALDH1A1 P00352 3/20 0.54
HSD17B10 Q99714 2/20 0.54
CYP1A2 P05177 1/20 0.54
RAB9A P51151 3/20 0.50
POLB P06746 1/20 0.50
NR4A1 P22736 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.49
NAPRT Q6XQN6 1/20 0.48
SMN1; SMN2 Q16637 2/20 0.47
NPC1 O15118 1/20 0.47
TP53 P04637 1/20 0.46
NQO2 P16083 1/20 0.45
NPSR1 Q6W5P4 1/20 0.44

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
SCHEMBL12927928 1.00 MAPT (0.56) MAPTALDH1A1HSD17B10CYP1A2RAB9A
SCHEMBL24146774 0.88 MTNR1A (0.51) MAPTALDH1A1HSD17B10CYP1A2RAB9A
SCHEMBL24146776 0.88 MAPT (0.46) MAPTALDH1A1HSD17B10CYP1A2RAB9A
SCHEMBL24146775 0.87 NPSR1 (0.50) MAPTALDH1A1HSD17B10CYP1A2RAB9A
SCHEMBL24147284 0.86 LMNA (0.51) MAPTALDH1A1HSD17B10CYP1A2L3MBTL1
SCHEMBL2921891 0.85 ALDH1A1 (0.57) MAPTALDH1A1HSD17B10CYP1A2RAB9A
SCHEMBL12948561 0.85 GPR35 (0.43) MAPTALDH1A1HSD17B10RAB9APOLB
SCHEMBL11428932 0.83 RAB9A (0.58) MAPTALDH1A1CYP1A2RAB9APOLB
SCHEMBL10494613 0.81 MAPT (0.72) MAPTALDH1A1HSD17B10CYP1A2RAB9A
SCHEMBL10494616 0.81 MAPT (0.72) MAPTALDH1A1HSD17B10CYP1A2RAB9A

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-4405346-A2 SMALL MOLECULE INHIBITORS OF TEAD-YAP The General Hospital Corporation (US) 2024-07-31 EP disclosed
WO-2023049808-A2 SMALL MOLECULE INHIBITORS OF TEAD-YAP THE GENERAL HOSPITAL CORPORATION (US) 2023-03-30 WO disclosed