SCHEMBL11260239

SCHEMBL11260239

CC1(C)c2cc(OS(C)(=O)=O)ccc2OC1O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.42
CA2 P00918 3/20 0.40
CA5A P35218 2/20 0.40
HPGD P15428 1/20 0.40
ALPL P05186 2/20 0.36
ALPI P09923 1/20 0.36
KDM4E B2RXH2 4/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 5/20 0.34
LMNA P02545 3/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
HTT P42858 1/20 0.34
PSMD14 O00487 1/20 0.34
POLB P06746 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
PLIN1 O60240 1/20 0.34
USP2 O75604 1/20 0.34
MAPK1 P28482 1/20 0.34

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
SCHEMBL11669795 0.88 CA2 (0.37) ALDH1A1CA2STSCA12BCHE
SCHEMBL19308105 0.85 CA2 (0.42) ALDH1A1CA2CA5AHPGDALPL
SCHEMBL11669133 0.85 RAB9A (0.40) ALDH1A1CA2GAAMAPTLMNA
SCHEMBL9619914 0.85 HSD11B1 (0.39) CA2
SCHEMBL11260755 0.83 CA2 (0.39) ALDH1A1CA2CA5AHPGDALPL
SCHEMBL11806875 0.82 ACHE (0.34) ALDH1A1HPGDLMNAHTTSTS
SCHEMBL11269387 0.82 CA2 (0.39) ALDH1A1CA2CA5AHPGDALPL
SCHEMBL11269026 0.82 CA2 (0.39) ALDH1A1CA2CA5AHPGDALPL
SCHEMBL11257436 0.81 ALDH1A1 (0.39) ALDH1A1CA2CA5AHPGDALPL
SCHEMBL11812672 0.79 KCNE1 (0.32) BCHEACHE

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
US-4345932-A BENZOFURANYL ESTERS FISONS LIMITED (GB) 1982-08-24 US disclosed
US-4157255-A 2-AMINO-BENZOFURAN-2-YL METHANE SULFONATE FISONS LIMITED (GB) 1979-06-05 US disclosed
US-4120871-A HERBICIDES, PLANT GROWTH REGULATORS FISONS LIMITED (GB) 1978-10-17 US disclosed