SCHEMBL8950426

SCHEMBL8950426

CCOC(=O)C1=Cc2ccsc2S(=O)(=O)N1C(C)C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.39
POLB P06746 4/20 0.36
HSD17B10 Q99714 3/20 0.36
KDM4E B2RXH2 2/20 0.35
MAPT P10636 7/20 0.34
ALDH1A1 P00352 3/20 0.34
MAPK1 P28482 2/20 0.34
ATM Q13315 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
GAA P10253 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
LMNA P02545 1/20 0.33
PKM P14618 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32

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
SCHEMBL8950389 0.76 PTGER4 (0.34) TSHRPOLBHSD17B10KDM4EMAPT
SCHEMBL9058353 0.75 TSHR (0.40) TSHRPOLBHSD17B10KDM4EMAPT
SCHEMBL8950417 0.74 ALDH1A1 (0.44) TSHRHSD17B10KDM4EMAPTALDH1A1
SCHEMBL8950076 0.74 FEN1 (0.46) HSD17B10KDM4EMAPTALDH1A1MAPK1
SCHEMBL8950132 0.70 MAPT (0.39) TSHRPOLBHSD17B10KDM4EMAPT
SCHEMBL8950215 0.66 HSD11B1 (0.44) TSHRPOLBHSD17B10KDM4EMAPT
SCHEMBL9057057 0.64 MAPT (0.36) TSHRPOLBHSD17B10KDM4EMAPT
SCHEMBL9058117 0.62 FEN1 (0.47) POLBHSD17B10KDM4EMAPTALDH1A1
SCHEMBL25060076 0.61 MAPT (0.42) TSHRPOLBHSD17B10KDM4EMAPT
SCHEMBL162212 0.60 TSHR (0.55) TSHRPOLBHSD17B10KDM4EMAPT

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5538966-A ENZYME INHIBITORS FOR TREATMENT OF GLAUCOMA ALCON LABORATORIES, INC. (US) 1996-07-23 US disclosed