SCHEMBL8074580

SCHEMBL8074580

Cc1ccc(C(=O)C[S+](c2ccccc2)c2ccccc2)cc1.Cc1ccc(S(=O)(=O)[O-])cc1

nearest known ligand 0.52

Known targets — ChEMBL curated mechanism

CHRM1CHRM2CHRM3CHRM4CHRM5SLC6A2dacAdacBdacCftsImrcAmrcBmrdA

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.52
HSD11B1 P28845 1/20 0.52
KMT2A Q03164 5/20 0.49
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
MEN1 O00255 1/20 0.49
TAS2R14 Q9NYV8 1/20 0.45
ALDH1A1 P00352 2/20 0.43
TP53 P04637 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
PAX8 Q06710 1/20 0.42
LMNA P02545 1/20 0.42
PTGS2 P35354 1/20 0.42
CES2 O00748 1/20 0.41
CES1 P23141 1/20 0.41
PKM P14618 2/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA9 Q16790 1/20 0.41

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
SCHEMBL9003649 0.89 KMT2A (0.59) RECQLHSD11B1KMT2ANPC1RAB9A
Perchlorate SCHEMBL8752338 0.87 KMT2A (0.53) RECQLHSD11B1KMT2ANPC1RAB9A
SCHEMBL1095578 0.78 TDP1 (0.54) RECQLKMT2ANPC1RAB9AMEN1
SCHEMBL8060330 0.77 HSD11B1 (0.57) HSD11B1KMT2ANPC1RAB9AMEN1
Trifluoromethanesulfonic Acid SCHEMBL9626694 0.77 CES1 (0.39) RECQLHSD11B1KMT2AMEN1ALDH1A1
SCHEMBL11347502 0.76 CYP3A4 (0.45) RECQLALDH1A1TDP1LMNACA12
SCHEMBL9003684 0.76 KMT2A (0.44) HSD11B1KMT2ANPC1RAB9AMEN1
Perchlorate SCHEMBL9003671 0.75 TDP1 (0.47) RECQLKMT2ANPC1RAB9AMEN1
SCHEMBL11345003 0.75 CYP3A4 (0.44) RECQLALDH1A1TDP1LMNACA12
SCHEMBL7133269 0.74 CA12 (0.47) RECQLKMT2AMEN1ALDH1A1TDP1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0665470-B1 Method for forming a fine pattern MATSUSHITA ELECTRIC INDUSTRIAL CO LTD (JP) 2000-08-02 EP disclosed
US-5518579-A SEMICONDUCTORS MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) 1996-05-21 US disclosed
EP-0665470-A2 Method for forming a fine pattern MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) 1995-08-02 EP disclosed