SCHEMBL10595490

SCHEMBL10595490

Nc1ccc(S(=O)(=O)c2ccc(Cc3ccc(S(=O)(=O)c4ccc(N)cc4)cc3)cc2)cc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.73
HTR6 P50406 4/20 0.73
CYP3A4 P08684 3/20 0.73
LMNA P02545 1/20 0.73
MPO P05164 1/20 0.73
CYP2C9 P11712 1/20 0.73
CA1 P00915 6/20 0.66
CA2 P00918 6/20 0.66
CA9 Q16790 6/20 0.66
CA12 O43570 4/20 0.66
CA14 Q9ULX7 3/20 0.66
ALDH1A1 P00352 3/20 0.64
TDP1 Q9NUW8 2/20 0.64
MEN1 O00255 1/20 0.59
KMT2A Q03164 1/20 0.59
PKM P14618 2/20 0.55
CA7 P43166 3/20 0.50
CA4 P22748 2/20 0.50
CA6 P23280 2/20 0.50
CA5A P35218 2/20 0.50

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
SCHEMBL7858527 1.00 TSHR (0.73) TSHRHTR6CYP3A4LMNAMPO
Dapsone SCHEMBL10353007 1.00 TSHR (0.73) TSHRHTR6CYP3A4LMNAMPO
Dapsone SCHEMBL1219599 0.85 HTR6 (1.00) TSHRHTR6CYP3A4LMNAMPO
Dapsone SCHEMBL5055312 0.85 HTR6 (1.00) TSHRHTR6CYP3A4LMNAMPO
SCHEMBL10596934 0.85 HTR6 (1.00) TSHRHTR6CYP3A4LMNAMPO
Dapsone SCHEMBL21428 0.85 HTR6 (1.00) TSHRHTR6CYP3A4LMNAMPO
SCHEMBL324893 0.85 HTR6 (1.00) TSHRHTR6CYP3A4LMNAMPO
SCHEMBL151654 0.84 HTR6 (0.70) TSHRHTR6CYP3A4LMNAMPO
Dapsone SCHEMBL2203636 0.83 HTR6 (0.94) TSHRHTR6CYP3A4LMNAMPO
Dapsone SCHEMBL9690514 0.83 HTR6 (0.94) TSHRHTR6CYP3A4LMNAMPO

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-0162606-B1 AROMATIC POLYTHIOETHERAMIDES AND PROCESS FOR THEIR PRODUCTION MITSUBISHI PETROCHEMICAL CO., LTD. (JP) 1989-01-25 EP disclosed
US-4621134-A Aromatic polythioetheramide MITSUBISHI PETROCHEMICAL CO., LTD. (JP) 1986-11-04 US disclosed
EP-0162606-A1 Aromatic polythioetheramides and process for their production MITSUBISHI PETROCHEMICAL CO., LTD. (JP) 1985-11-27 EP disclosed