SCHEMBL28085692

SCHEMBL28085692

CC=C(C(=O)OC)c1cccs1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.50
TSHR P16473 2/20 0.50
CES2 O00748 1/20 0.50
CES1 P23141 1/20 0.50
APLNR P35414 1/20 0.50
HDAC1 Q13547 1/20 0.50
DAO P14920 1/20 0.48
RAB9A P51151 6/20 0.48
MAPT P10636 4/20 0.48
NPC1 O15118 4/20 0.48
TDP1 Q9NUW8 2/20 0.48
KMT2A Q03164 4/20 0.48
ALDH1A1 P00352 3/20 0.48
TP53 P04637 3/20 0.48
MEN1 O00255 3/20 0.48
CYP3A4 P08684 1/20 0.48
MAPK1 P28482 1/20 0.48
HSD17B10 Q99714 1/20 0.48
GAA P10253 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47

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
SCHEMBL8648541 0.86 TSHR (0.48) HPGDTSHRCES2CES1APLNR
SCHEMBL7702480 0.81 CES2 (0.50) HPGDTSHRCES2CES1APLNR
SCHEMBL2812942 0.81 DAO (0.42) HPGDTSHRCES2CES1APLNR
SCHEMBL2812946 0.81 DAO (0.42) HPGDTSHRCES2CES1APLNR
SCHEMBL1233245 0.81 CES2 (0.65) HPGDTSHRCES2CES1APLNR
SCHEMBL9709878 0.79 DAO (0.59) HPGDCES2CES1HDAC1DAO
SCHEMBL9709882 0.79 DAO (0.59) HPGDCES2CES1HDAC1DAO
SCHEMBL28465227 0.77 CES2 (0.54) HPGDCES2CES1HDAC1DAO
SCHEMBL9710031 0.77 CES2 (0.54) HPGDTSHRCES2CES1HDAC1
SCHEMBL9710026 0.77 CES2 (0.54) HPGDTSHRCES2CES1HDAC1

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
CN-103874742-B Carbazolocarbazole-bis (dicarboximides) and their use as semiconductors 巴斯夫欧洲公司 2016-08-17 CN disclosed