SCHEMBL4211985

SCHEMBL4211985

C(OCC1CO1)C1CO1.OCCOc1ccc(C2(c3ccc(OCCO)cc3)c3ccccc3-c3ccccc32)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 7/20 0.42
TDP1 Q9NUW8 1/20 0.41
ALOX5AP P20292 1/20 0.40
ALDH1A1 P00352 4/20 0.39
RECQL P46063 1/20 0.39
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
MAPT P10636 3/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
LMNA P02545 2/20 0.36
KDM4E B2RXH2 1/20 0.36
OPRK1 P41145 1/20 0.36
GAA P10253 2/20 0.35
GPR174 Q9BXC1 1/20 0.35
TP53 P04637 3/20 0.35
TSHR P16473 3/20 0.35
HIF1A Q16665 2/20 0.35
CYP3A4 P08684 1/20 0.35
HPGD P15428 2/20 0.35
CYP1A2 P05177 1/20 0.35

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
SCHEMBL29420739 0.89 TDP1 (0.44) PDK2TDP1ALDH1A1MEN1KMT2A
SCHEMBL193740 0.89 TDP1 (0.44) PDK2TDP1ALDH1A1MEN1KMT2A
SCHEMBL21829149 0.88 TDP1 (0.41) PDK2TDP1ALDH1A1MEN1KMT2A
SCHEMBL13319936 0.88 TDP1 (0.48) PDK2TDP1ALOX5APALDH1A1MEN1
SCHEMBL20492222 0.88 TDP1 (0.43) PDK2TDP1ALDH1A1MEN1KMT2A
SCHEMBL21970081 0.85 TDP1 (0.43) PDK2TDP1ALOX5APALDH1A1MEN1
SCHEMBL16172297 0.85 TDP1 (0.40) TDP1ALDH1A1MEN1KMT2AMAPT
SCHEMBL15700021 0.85 TDP1 (0.58) PDK2TDP1ALDH1A1MEN1KMT2A
SCHEMBL13827403 0.85 TDP1 (0.58) PDK2TDP1ALDH1A1MEN1KMT2A
SCHEMBL157321 0.85 TDP1 (0.58) PDK2TDP1ALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140349218-A1 PHOTOSENSITIVE MATERIAL, HOLOGRAPHIC RECORDING MEDIUM AND HOLOGRAPHIC RECORDING METHOD NIPPON STEEL & SUMIKIN CHEMICAL CO., LTD (JP) 2014-11-27 US disclosed
US-8298726-B2 Volume phase hologram recording material and optical information recording medium NIPPON STEEL CHEMICAL CO., LTD. (JP) 2012-10-30 US disclosed
EP-2110718-B1 VOLUME PHASE HOLOGRAM RECORDING MATERIAL AND OPTICAL INFORMATION RECORDING MEDIUM NIPPON STEEL CHEMICAL CO (JP) 2012-10-10 EP disclosed
US-20090310196-A1 VOLUME PHASE HOLOGRAM RECORDING MATERIAL AND OPTICAL INFORMATION RECORDING MEDIUM NIPPON STEEL & SUMIKIN CHEMICAL CO., LTD. (JP) 2009-12-17 US disclosed
EP-2110718-A1 VOLUME PHASE HOLOGRAM RECORDING MATERIAL AND OPTICAL INFORMATION RECORDING MEDIUM Nippon Steel Chemical Co., Ltd. (JP) 2009-10-21 EP disclosed