SCHEMBL10513618

SCHEMBL10513618

C=CCc1cccc2c1Sc1ccccc1O2

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.38
GABRB2 P47870 1/20 0.38
MEN1 O00255 4/20 0.35
KMT2A Q03164 4/20 0.35
MAPT P10636 3/20 0.35
MAPK1 P28482 1/20 0.35
GAA P10253 1/20 0.33
ATM Q13315 1/20 0.33
PKM P14618 3/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
AURKA O14965 1/20 0.31
DAPK3 O43293 1/20 0.31
MAP4K4 O95819 1/20 0.31
RET P07949 1/20 0.31
IGF1R P08069 1/20 0.31
MET P08581 1/20 0.31
PIM1 P11309 1/20 0.31
LTK P29376 1/20 0.31
KDR P35968 1/20 0.31
MAPK8 P45983 1/20 0.31

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
SCHEMBL7875601 0.80 GABRA1 (0.44) GABRA1GABRB2MEN1KMT2AMAPT
SCHEMBL7048181 0.79 GABRA1 (0.47) GABRA1GABRB2MEN1KMT2AMAPT
SCHEMBL1627755 0.79 MAOA (0.44) GABRA1GABRB2ATMNPSR1HTT
SCHEMBL9934272 0.79 MAOA (0.34) MEN1KMT2AATML3MBTL1NPSR1
SCHEMBL9934275 0.79 APOBEC3G (0.33) MEN1KMT2AL3MBTL1NPSR1ALDH1A1
SCHEMBL3061595 0.76 ALDH1A1 (0.34) ATMALDH1A1
SCHEMBL24828779 0.75 RIPK1 (0.35) ATML3MBTL1
SCHEMBL10422639 0.74 AKR1B1 (0.43) AKR1B1NPSR1ALDH1A1
SCHEMBL9934469 0.73 ATM (0.34) ATM
SCHEMBL10512560 0.73 CYP3A4 (0.56) GABRA1GABRB2MEN1KMT2AMAPT

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
EP-0320954-A2 Transparent resin and transparent resin products NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1989-06-21 EP claimed
EP-0320954-A2 Transparent resin and transparent resin products NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1989-06-21 EP disclosed