SCHEMBL8299877

SCHEMBL8299877

COc1ccc2cc(S(=O)(=O)NC(=O)c3ccc(F)cc3)ccc2c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BCL2L1 Q07817 2/20 0.56
▸ MCL1 Q07820 2/20 0.56
▸ PLAU P00749 2/20 0.54
▸ RAPGEF3 O95398 1/20 0.54
▸ PTGS2 P35354 2/20 0.52
▸ EGFR P00533 1/20 0.52
▸ ERBB2 P04626 1/20 0.52
▸ PKM P14618 1/20 0.52
▸ PTGS1 P23219 1/20 0.51
▸ HDAC1 Q13547 1/20 0.49
▸ HDAC6 Q9UBN7 1/20 0.49
▸ HSD17B10 Q99714 1/20 0.49
▸ GFER P55789 1/20 0.49
▸ P4HTM Q9NXG6 1/20 0.48
▸ KAT6A Q92794 1/20 0.48
▸ FLT1 P17948 1/20 0.48
▸ FLT4 P35916 1/20 0.48
▸ KDR P35968 1/20 0.48
▸ HTR7 P34969 1/20 0.48
▸ LMNA P02545 1/20 0.47

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
SCHEMBL795861 0.75 ALDH1A1 (0.64) PTGS2EGFRHSD17B10GFERP4HTM
SCHEMBL23447714 0.75 KMT2A (0.73) BCL2L1MCL1PTGS2EGFRERBB2
SCHEMBL8768073 0.74 NPC1 (0.66) RAPGEF3HSD17B10LMNASMN1; SMN2MEN1
SCHEMBL29869451 0.73 KDM4E (0.62) PLAUHSD17B10LMNAHPGDSMN1; SMN2
SCHEMBL21679476 0.73 KDM4E (0.62) PLAUHSD17B10LMNAHPGDSMN1; SMN2
SCHEMBL9175525 0.73 KAT6A (0.76) BCL2L1MCL1PTGS2EGFRPTGS1
SCHEMBL29644482 0.72 KAT6A (0.73) BCL2L1MCL1KAT6AFLT1FLT4
SCHEMBL10745409 0.72 GAA (0.59) BCL2L1MCL1PTGS2EGFRERBB2
SCHEMBL15766090 0.72 P4HTM (0.51) PLAURAPGEF3PTGS2PTGS1HSD17B10
SCHEMBL28698398 0.71 PTGS2 (0.71) BCL2L1MCL1PTGS2EGFRERBB2

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-0966437-A1 5-AROYLNAPHTHALENE DERIVATIVES F.HOFFMANN-LA ROCHE AG (CH) 1999-12-29 — — EP disclosed
WO-1998032732-A1 5-AROYLNAPHTHALENE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 1998-07-30 — — WO disclosed
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