SCHEMBL7699313

SCHEMBL7699313

O=[C]CSc1ccccc1O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DBH P09172 2/20 0.37
PTGS2 P35354 4/20 0.37
PNP P00491 1/20 0.36
ALOX15 P16050 2/20 0.36
KDM4E B2RXH2 1/20 0.36
NPC1 O15118 1/20 0.36
CA12 O43570 1/20 0.36
GMNN O75496 1/20 0.36
ALDH1A1 P00352 1/20 0.36
EGFR P00533 1/20 0.36
CA2 P00918 1/20 0.36
LMNA P02545 1/20 0.36
FYN P06241 1/20 0.36
POLB P06746 1/20 0.36
CA3 P07451 1/20 0.36
CYP3A4 P08684 1/20 0.36
MAPT P10636 1/20 0.36
MMP9 P14780 1/20 0.36
HPGD P15428 1/20 0.36
NFKB1 P19838 1/20 0.36

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
SCHEMBL5178458 0.79 CA12 (0.39) PTGS2ALOX15KDM4ENPC1CA12
SCHEMBL11687745 0.75 MCHR1 (0.42) PTGS2NPC1LMNAPOLBMAPT
SCHEMBL2953965 0.75 RAB9A (0.42) PTGS2KDM4ENPC1ALDH1A1LMNA
SCHEMBL11791700 0.75 HTR7 (0.47) PTGS2ALDH1A1CA2LMNAMAPT
SCHEMBL5541910 0.75 SMN1; SMN2 (0.42) PTGS2ALOX15NPC1ALDH1A1LMNA
SCHEMBL8397211 0.75 LMNA (0.45) DBHALOX15KDM4ENPC1CA12
SCHEMBL68951 0.75 HSPA5 (0.46) PTGS2ALOX15KDM4ENPC1CA12
SCHEMBL9781953 0.75 CYP1A2 (0.62) ALOX15NPC1CA12GMNNALDH1A1
SCHEMBL11356940 0.72 SLC6A2 (0.39) PTGS2POLB
SCHEMBL5385179 0.72 HDAC3 (0.42) ALDH1A1CA2LMNAMAPTHPGD

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-6395446-B1 CONTAINING SULFONYLDIAZOMETHANE COMPOUND AS ACID GENERATOR SHIN-ETSU CHEMICAL CO., LTD. (JP) 2002-05-28 US disclosed
US-6338931-B1 PHOTOACID GENERATOR OF SULFONYLDIAZOMETHANE COMPOUND SHIN-ETSU CHEMICAL CO., LTD. (JP) 2002-01-15 US disclosed