SCHEMBL651802

SCHEMBL651802

ON=Cc1c(OCC2CO2)ccc2ccccc12

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.61
KDM4E B2RXH2 3/20 0.57
MEN1 O00255 6/20 0.56
KMT2A Q03164 6/20 0.56
ALDH1A1 P00352 4/20 0.56
NPC1 O15118 2/20 0.56
RAB9A P51151 2/20 0.56
XBP1 P17861 1/20 0.56
NPSR1 Q6W5P4 1/20 0.56
GLA P06280 1/20 0.44
POLB P06746 3/20 0.41
TSHR P16473 1/20 0.41
MAPT P10636 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
G6PD P11413 1/20 0.41
TDP1 Q9NUW8 2/20 0.41
MAPK1 P28482 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.39
GAA P10253 1/20 0.39
PDK1 Q15118 1/20 0.38

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
SCHEMBL10019290 1.00 HPGD (0.61) HPGDKDM4EMEN1KMT2AALDH1A1
SCHEMBL28617703 0.85 HPGD (0.53) HPGDKDM4EMEN1KMT2AALDH1A1
SCHEMBL22171037 0.85 HPGD (0.53) HPGDKDM4EMEN1KMT2AALDH1A1
SCHEMBL30267579 0.84 HPGD (0.55) HPGDKDM4EMEN1KMT2AALDH1A1
SCHEMBL26376100 0.84 HPGD (0.55) HPGDKDM4EMEN1KMT2AALDH1A1
SCHEMBL22163944 0.83 MAPT (0.58) HPGDKDM4EMEN1KMT2AALDH1A1
SCHEMBL30360584 0.83 MAPT (0.58) HPGDKDM4EMEN1KMT2AALDH1A1
SCHEMBL654030 0.83 MAPT (0.58) HPGDKDM4EMEN1KMT2AALDH1A1
SCHEMBL13986687 0.83 ALDH1A1 (0.48) HPGDKDM4EMEN1KMT2AALDH1A1
SCHEMBL12290141 0.81 HPGD (0.74) HPGDKDM4EMEN1KMT2AALDH1A1

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
US-8507611-B2 Crosslinkable polymer material, crosslinked polymer material, and production method thereof TOYODA GOSEI CO., LTD. (JP) 2013-08-13 US disclosed
US-20120046418-A1 CROSSLINKABLE POLYMER MATERIAL, CROSSLINKED POLYMER MATERIAL, AND PRODUCTION METHOD THEREOF TOKYO INSTITUTE OF TECHNOLOGY (JP) 2012-02-23 US disclosed