SCHEMBL15848488

SCHEMBL15848488

OCCN(CCO)Cc1cccc2[nH]nnc12

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 2/20 0.37
CDK1 P06493 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
PNP P00491 3/20 0.36
EGFR P00533 1/20 0.32
MEN1 O00255 1/20 0.32
MAPK1 P28482 1/20 0.32
KMT2A Q03164 1/20 0.32
HDAC3 O15379 1/20 0.31
CYP3A4 P08684 1/20 0.31
HDAC4 P56524 1/20 0.31
KCNH2 Q12809 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC7 Q8WUI4 1/20 0.31
HDAC2 Q92769 1/20 0.31
HDAC10 Q969S8 1/20 0.31
HDAC11 Q96DB2 1/20 0.31
HDAC8 Q9BY41 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
HDAC9 Q9UKV0 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
SCHEMBL31488119 1.00 PARP1 (0.37) PARP1CDK1SMN1; SMN2PNPEGFR
SCHEMBL11329938 0.97 PARP1 (0.34) PARP1CDK1SMN1; SMN2PNPMEN1
SCHEMBL8511224 0.85 HRH3 (0.35) MEN1MAPK1KMT2ACYP3A4KCNH2
SCHEMBL535020 0.82 BCHE (0.39) MEN1KMT2ATSHR
SCHEMBL284673 0.81 MAPT (0.44) CDK1MEN1MAPK1KMT2AALDH1A1
SCHEMBL8510900 0.81 BCHE (0.37) KCNH2ALDH1A1TSHR
SCHEMBL8513498 0.80 BCHE (0.39) KCNH2
SCHEMBL8511252 0.80 BCHE (0.39) KCNH2
SCHEMBL8512580 0.80 BCHE (0.39) KCNH2
SCHEMBL8514342 0.80 BCHE (0.39) KCNH2

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
EP-2938655-A2 CURABLE SILICONE COMPOSITION, CURED PRODUCT THEREOF, AND OPTICAL SEMICONDUCTOR DEVICE Dow Corning Toray Co., Ltd. (JP) 2015-11-04 EP disclosed
WO-2014104388-A2 CURABLE SILICONE COMPOSITION, CURED PRODUCT THEREOF, AND OPTICAL SEMICONDUCTOR DEVICE DOW CORNING TORAY CO., LTD. (JP) 2014-07-03 WO disclosed
WO-2014104389-A2 CURABLE SILICONE COMPOSITION, CURED PRODUCT THEREOF, AND OPTICAL SEMICONDUCTOR DEVICE DOW CORNING TORAY CO., LTD. (JP) 2014-07-03 WO disclosed