SCHEMBL22453774

SCHEMBL22453774

COC(=O)c1ccccc1Nc1ccc(S(=O)(=O)Nc2ccc(C34CC5CC(CC(C5)C3)C4)cc2Cl)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 5/20 0.47
▸ MAPK1 P28482 1/20 0.47
▸ KMT2A Q03164 4/20 0.45
▸ MEN1 O00255 3/20 0.45
▸ KDM4E B2RXH2 3/20 0.45
▸ HSD17B10 Q99714 2/20 0.45
▸ GAA P10253 2/20 0.43
▸ MAPT P10636 2/20 0.42
▸ ALOX15 P16050 1/20 0.42
▸ SMN1; SMN2 Q16637 3/20 0.42
▸ ELANE P08246 1/20 0.42
▸ PRTN3 P24158 1/20 0.42
▸ FFAR4 Q5NUL3 1/20 0.41
▸ PTK2 Q05397 2/20 0.40
▸ ALDH1A1 P00352 3/20 0.40
▸ HPGD P15428 2/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ CYP2D6 P10635 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ CRHBP P24387 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
SCHEMBL22453775 0.96 LMNA (0.49) LMNAMAPK1KMT2AMEN1KDM4E
SCHEMBL22452725 0.90 MEN1 (0.46) LMNAKMT2AMEN1KDM4EALDH1A1
SCHEMBL22453525 0.90 MAPT (0.50) LMNAKMT2AMEN1HSD17B10MAPT
SCHEMBL22453477 0.89 LMNA (0.42) LMNAMAPK1KMT2AMEN1KDM4E
SCHEMBL22453772 0.88 MAPT (0.48) LMNAMAPK1KMT2AMEN1KDM4E
SCHEMBL22452983 0.86 MEN1 (0.48) LMNAKMT2AMEN1KDM4EHSD17B10
SCHEMBL22452790 0.84 SERPINE1 (0.51) LMNAKMT2AMEN1KDM4EHSD17B10
SCHEMBL22453680 0.82 SERPINE1 (0.53) LMNAKMT2AMEN1KDM4EHSD17B10
SCHEMBL22453205 0.82 MAPT (0.46) MAPTALOX15CYP3A4
SCHEMBL22452503 0.81 MAPT (0.58) LMNAKDM4EHSD17B10MAPTALOX15

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-2020190774-A1 NOVEL SMALL MOLECULE INHIBITORS OF TEAD TRANSCRIPTION FACTORS THE GENERAL HOSPITAL CORPORATION (US) 2020-09-24 — — WO disclosed
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