SCHEMBL10770107

SCHEMBL10770107

Cc1ccc(S(N)(=O)=O)cc1N=N

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 10/20 0.45
CA2 P00918 10/20 0.45
CA9 Q16790 9/20 0.45
CA12 O43570 8/20 0.45
CA6 P23280 5/20 0.45
CA5A P35218 5/20 0.45
CA7 P43166 5/20 0.45
CA5B Q9Y2D0 5/20 0.45
CA3 P07451 1/20 0.45
POLB P06746 2/20 0.42
HTT P42858 1/20 0.42
PTGS1 P23219 1/20 0.41
PTGS2 P35354 1/20 0.41
CA4 P22748 4/20 0.40
CA14 Q9ULX7 4/20 0.40
MAPT P10636 2/20 0.40
LMNA P02545 1/20 0.40
PKM P14618 2/20 0.40
SOS1 Q07889 1/20 0.39
KDM4E B2RXH2 1/20 0.39

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
SCHEMBL3665121 0.83 CA2 (0.47) CA1CA2CA9CA12CA6
SCHEMBL233320 0.76 LMNA (0.61) CA1CA2CA9CA12CA6
SCHEMBL29365636 0.76 LMNA (0.61) CA1CA2CA9CA12CA6
SCHEMBL23536145 0.72 PDIA6 (0.53) CA1CA2CA9CA12CA6
SCHEMBL6669968 0.72 CA2 (0.55) CA1CA2CA9CA12CA6
SCHEMBL1925948 0.72 CA2 (0.52) CA1CA2CA9CA12CA6
SCHEMBL1368195 0.72 CA2 (0.61) CA1CA2CA9CA12CA6
SCHEMBL588896 0.72 CA2 (0.61) CA1CA2CA9CA12CA6
SCHEMBL11374683 0.72 CA2 (0.47) CA1CA2CA9CA12CA6
SCHEMBL2011324 0.71 CA2 (0.62) CA1CA2CA9CA12CA6

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-4652531-A Fluorescent protein binding assays with unsymmetrical fluorescein derivatives SYNTEX (U.S.A.) INC. (US) 1987-03-24 US disclosed
US-4439356-A XANTHENES, IMMUNOASSAY SYVA COMPANY (US) 1984-03-27 US disclosed