SCHEMBL22445145

SCHEMBL22445145

COC(=O)c1ccccc1Nc1ccc(C(=O)O)cc1

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.79
▸ ALOX15 P16050 1/20 0.79
▸ SIRT2 Q8IXJ6 3/20 0.67
▸ AURKA O14965 3/20 0.56
▸ POLB P06746 2/20 0.56
▸ KDM4E B2RXH2 2/20 0.56
▸ ATM Q13315 1/20 0.56
▸ FABP4 P15090 1/20 0.54
▸ AKR1C3 P42330 4/20 0.54
▸ AKR1C2 P52895 4/20 0.54
▸ HPGD P15428 2/20 0.52
▸ MAPK10 P53779 1/20 0.52
▸ KMT2A Q03164 4/20 0.51
▸ CYP1A2 P05177 1/20 0.51
▸ CYP2D6 P10635 1/20 0.51
▸ TSHR P16473 1/20 0.51
▸ CYP2C19 P33261 1/20 0.51
▸ MEN1 O00255 3/20 0.51
▸ APAF1 O14727 1/20 0.51
▸ NSD2 O96028 1/20 0.51

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
SCHEMBL31168050 1.00 MAPT (0.79) MAPTALOX15SIRT2AURKAPOLB
SCHEMBL13224505 0.90 MAPT (0.89) MAPTALOX15SIRT2AURKAPOLB
SCHEMBL31914 0.89 MAPT (1.00) MAPTALOX15SIRT2AURKAPOLB
SCHEMBL28649151 0.86 MAPT (0.81) MAPTALOX15SIRT2AURKAPOLB
SCHEMBL12109319 0.85 MAPT (0.81) MAPTALOX15SIRT2AURKAPOLB
SCHEMBL29514750 0.85 FABP4 (0.73) MAPTALOX15SIRT2AURKAPOLB
SCHEMBL11325566 0.85 FABP4 (0.73) MAPTALOX15SIRT2AURKAPOLB
SCHEMBL28658698 0.84 MAPT (0.78) MAPTALOX15SIRT2AURKAPOLB
SCHEMBL22453219 0.84 MAPT (0.72) MAPTALOX15SIRT2AURKAPOLB
SCHEMBL22452889 0.83 MAPT (0.76) MAPTALOX15SIRT2AURKAPOLB

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
EP-3937943-A1 NOVEL SMALL MOLECULE INHIBITORS OF TEAD TRANSCRIPTION FACTORS The General Hospital Corporation (US) 2022-01-19 — — EP disclosed
CN-113811300-A Novel small molecule inhibitors of TEAD transcription factor 总医院公司 2021-12-17 — — CN disclosed
WO-2020190774-A1 NOVEL SMALL MOLECULE INHIBITORS OF TEAD TRANSCRIPTION FACTORS THE GENERAL HOSPITAL CORPORATION (US) 2020-09-24 — — WO disclosed
WO-2020190774-A1 NOVEL SMALL MOLECULE INHIBITORS OF TEAD TRANSCRIPTION FACTORS THE GENERAL HOSPITAL CORPORATION (US) 2020-09-24 — — WO disclosed
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