SCHEMBL11400151

SCHEMBL11400151

O=C(O)c1csc(Sc2ccccc2)c1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DAO P14920 5/20 0.47
HPGD P15428 3/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2C9 P11712 1/20 0.44
HSD17B10 Q99714 1/20 0.44
ALDH1A1 P00352 1/20 0.43
TSHR P16473 1/20 0.41
NAPRT Q6XQN6 1/20 0.41
TDP1 Q9NUW8 2/20 0.39
POLB P06746 1/20 0.39
APEX1 P27695 1/20 0.39
SIRT1 Q96EB6 1/20 0.37
MAPT P10636 1/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
CES2 O00748 1/20 0.36
CES1 P23141 1/20 0.36
SRD5A2 P31213 1/20 0.36
KMO O15229 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
SCHEMBL28085235 0.86 SIRT1 (0.46) HPGDHSD17B10ALDH1A1TSHRTDP1
SCHEMBL7826134 0.86 HPGD (0.58) DAOHPGDALDH1A1TDP1POLB
SCHEMBL11401871 0.85 SIRT2 (0.43) DAOHPGDALDH1A1TDP1SIRT1
SCHEMBL11403171 0.84 BCL2L1 (0.43) DAOHPGDCYP1A2CYP2C9ALDH1A1
SCHEMBL11403619 0.84 DAO (0.50) DAOHPGDHSD17B10ALDH1A1POLB
SCHEMBL11394602 0.84 DAO (0.46) DAOHPGDCYP1A2CYP2C9HSD17B10
SCHEMBL11398649 0.84 DAO (0.46) DAOHPGDCYP1A2CYP2C9HSD17B10
SCHEMBL11403991 0.84 CYP1A2 (0.41) DAOHPGDCYP1A2CYP2C9HSD17B10
SCHEMBL28085217 0.82 TSHR (0.50) HPGDHSD17B10ALDH1A1TSHRMAPT
SCHEMBL11403765 0.80 SRD5A2 (0.48) ALDH1A1POLBMAPTMEN1KMT2A

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
CN-103446720-B Golf ball 邓禄普体育用品株式会社 2017-05-10 CN disclosed
CN-103446725-B Golf 邓禄普体育用品株式会社 2016-08-10 CN disclosed
US-4282246-A Antidiabetic furancarboxylic and thiphenecarboxylic acids PFIZER INC. (US) 1981-08-04 US disclosed