SCHEMBL7875601

SCHEMBL7875601

C=CCc1cccc2c1Sc1ccccc1S2

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 2/20 0.44
GABRB2 P47870 2/20 0.44
ALOX5 P09917 1/20 0.38
AKR1B1 P15121 1/20 0.35
KMT2A Q03164 3/20 0.34
MEN1 O00255 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MAPT P10636 1/20 0.33
MAPK1 P28482 1/20 0.33
ALDH1A1 P00352 3/20 0.33
KDM4E B2RXH2 1/20 0.33
AURKA O14965 1/20 0.32
DAPK3 O43293 1/20 0.32
MAP4K4 O95819 1/20 0.32
RET P07949 1/20 0.32
IGF1R P08069 1/20 0.32
MET P08581 1/20 0.32
PIM1 P11309 1/20 0.32
LTK P29376 1/20 0.32
KDR P35968 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
SCHEMBL7048181 0.96 GABRA1 (0.47) GABRA1GABRB2ALOX5AKR1B1KMT2A
SCHEMBL10513618 0.80 GABRA1 (0.38) GABRA1GABRB2AKR1B1KMT2AMEN1
SCHEMBL27700264 0.78 ALOX5 (0.36) ALOX5KMT2AMEN1
SCHEMBL27343656 0.78 ALOX5 (0.41) ALOX5KMT2AMEN1MAPTMAPK1
SCHEMBL27350738 0.74 ALOX5 (0.39) ALOX5KMT2AMEN1MAPTMAPK1
SCHEMBL2885407 0.74 GABRA1 (0.39) GABRA1GABRB2AKR1B1KMT2AMEN1
SCHEMBL31121326 0.74 ALOX5 (0.44) ALOX5KMT2AMEN1MAPTGAA
SCHEMBL9934467 0.74 ALOX5 (0.41) ALOX5KMT2AMEN1MAPTMAPK1
SCHEMBL9934471 0.74 ALOX5 (0.44) ALOX5KMT2AMEN1MAPTGAA
SCHEMBL12142036 0.74 GABRA1 (0.48) GABRA1GABRB2ALOX5MAPTGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0320954-A2 Transparent resin and transparent resin products NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1989-06-21 EP claimed
CN-116640077-A Synthesis method of 1, 1-diseleno olefin compound 浙江工业大学 2023-08-25 CN disclosed
US-6313075-B1 CATALYTICALLY REACTING IN PRESENCE OF CATALYST SELECTED FROM ZEOLITE BETA, ZEOLITE Y, ZSM-12 AND MCM-22, HYDROCARBYL SUBSTITUENT PRECURSOR HAVING AT LEAST ONE OLEFINIC GROUP AND THIANTHRENE MOBIL OIL CORPORATION A CORP. OF NY 2001-11-06 US disclosed
EP-0320954-A2 Transparent resin and transparent resin products NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1989-06-21 EP disclosed