SCHEMBL7192584

SCHEMBL7192584

Nc1ccc(S(=O)(=O)c2cc(N)cc(Br)c2)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 8/20 0.62
TSHR P16473 3/20 0.61
LMNA P02545 2/20 0.61
MPO P05164 1/20 0.61
CYP3A4 P08684 1/20 0.61
CYP2C9 P11712 1/20 0.61
ALDH1A1 P00352 3/20 0.53
PKM P14618 2/20 0.53
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
HTR2A P28223 1/20 0.48
HTR1D P28221 1/20 0.43
HTR2C P28335 1/20 0.43
CA12 O43570 2/20 0.43
CA1 P00915 2/20 0.43
CA2 P00918 2/20 0.43
CA9 Q16790 2/20 0.43
CA14 Q9ULX7 2/20 0.43
USP2 O75604 1/20 0.43
CA4 P22748 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
SCHEMBL2810440 0.90 HTR6 (0.47) HTR6TSHRLMNAMPOCYP3A4
SCHEMBL7190271 0.82 CA2 (0.58) HTR6TSHRLMNAMPOCYP3A4
SCHEMBL7191069 0.81 LMNA (0.71) HTR6TSHRLMNAALDH1A1PKM
SCHEMBL166250 0.81 HTR6 (0.76) HTR6TSHRLMNAMPOCYP3A4
SCHEMBL7138043 0.81 HTR6 (0.54) HTR6TSHRLMNAMPOCYP3A4
SCHEMBL7140761 0.80 HTR6 (0.67) HTR6TSHRLMNAMPOCYP3A4
SCHEMBL7135317 0.80 HTR6 (0.53) HTR6TSHRLMNAMPOCYP3A4
SCHEMBL7195439 0.79 HTR6 (0.40) HTR6TSHRLMNAMPOCYP3A4
Dapsone SCHEMBL1219599 0.78 HTR6 (1.00) HTR6TSHRLMNAMPOCYP3A4
SCHEMBL324893 0.78 HTR6 (1.00) HTR6TSHRLMNAMPOCYP3A4

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
US-20030064235-A1 Optical members made of polymide resins MITSUI CHEMICALS, INC. (JP) 2003-04-03 US disclosed
EP-1237015-A1 OPTICAL MEMBERS MADE OF POLYIMIDE RESINS Mitsui Chemicals, Inc. (JP) 2002-09-04 EP disclosed