SCHEMBL6682377

SCHEMBL6682377

COc1ccc(S(=O)(=O)c2[nH]c3ccccc3c2C=O)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 1/20 0.50
PTGS1 P23219 1/20 0.49
PKM P14618 1/20 0.47
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
KDM4E B2RXH2 3/20 0.47
ALDH1A1 P00352 3/20 0.47
CNR1 P21554 1/20 0.47
AHR P35869 1/20 0.46
MAPT P10636 3/20 0.45
NPC1 O15118 1/20 0.45
GAA P10253 1/20 0.45
RAB9A P51151 1/20 0.45
PTK2B Q14289 1/20 0.45
HPGD P15428 2/20 0.43
HSD17B10 Q99714 1/20 0.43
LMNA P02545 1/20 0.43
BRD4 O60885 1/20 0.43
SQSTM1 Q13501 1/20 0.43

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
SCHEMBL6166809 0.85 EGFR (0.55) PTGS2MEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL30542066 0.84 MEN1 (0.43) PTGS2MEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL5665323 0.84 MEN1 (0.43) PTGS2MEN1KMT2ASMN1; SMN2KDM4E
SCHEMBL7276190 0.80 KDM4E (0.56) PTGS2PTGS1PKMMEN1KMT2A
SCHEMBL15332438 0.77 PTGS2 (0.58) PTGS2PTGS1MEN1KMT2ASMN1; SMN2
SCHEMBL6684009 0.73 KDM4E (0.46) PTGS2PTGS1MEN1KMT2ASMN1; SMN2
SCHEMBL6682810 0.73 KDM4E (0.46) PTGS2PTGS1MEN1KMT2ASMN1; SMN2
SCHEMBL6681781 0.73 KDM4E (0.46) PTGS2PTGS1MEN1KMT2ASMN1; SMN2
SCHEMBL6679627 0.73 L3MBTL1 (0.45) PTGS2PTGS1MEN1KMT2ASMN1; SMN2
SCHEMBL7267915 0.72 PTGS2 (0.49) PTGS2PTGS1PKMMEN1KMT2A

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-1474390-A1 INDOLE DERIVATIVES SUBSTITUTED WITH LONG-CHAIN ALCOHOLS AND MEDICAMENTS CONTAINING THEM Meiji Dairies Corporation (JP) 2004-11-10 EP disclosed
WO-2003068741-A1 INDOLE DERIVATIVES SUBSTITUTED WITH LONG-CHAIN ALCOHOLS AND MEDICAMENTS CONTAINING THEM MEIJI DAIRIES CORPORATION (JP) 2003-08-21 WO disclosed