SCHEMBL1782045

SCHEMBL1782045

Cc1cccc(C)c1C.O=[PH](c1ccccc1)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.42
TRPA1 O75762 2/20 0.42
LMNA P02545 2/20 0.42
CYP1A2 P05177 2/20 0.42
MEN1 O00255 1/20 0.42
AKR1B10 O60218 1/20 0.42
ABCB11 O95342 1/20 0.42
DHFR P00374 1/20 0.42
MPO P05164 1/20 0.42
CYP3A4 P08684 1/20 0.42
CHRM1 P11229 1/20 0.42
CYP2C9 P11712 1/20 0.42
AKR1B1 P15121 1/20 0.42
PTGS1 P23219 1/20 0.42
PTGS2 P35354 1/20 0.42
AKR1C3 P42330 1/20 0.42
AKR1C2 P52895 1/20 0.42
KMT2A Q03164 1/20 0.42
AKR1C1 Q04828 1/20 0.42
HIF1A Q16665 1/20 0.42

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
SCHEMBL30466028 0.85 TRPA1 (0.35) TDP1TRPA1LMNACYP1A2MEN1
SCHEMBL1667 0.80 ALDH1A1 (0.35) TDP1LMNANAPRTTSHRACHE
SCHEMBL13583073 0.80 ALDH1A1 (0.35) TDP1LMNANAPRTTSHRACHE
Toluene SCHEMBL27845318 0.78 ACHE (0.58) TDP1LMNAMEN1AKR1C3KMT2A
Methyl Alcohol SCHEMBL28358130 0.78 CA2 (0.38) TDP1LMNANAPRTTSHRACHE
SCHEMBL2154468 0.77 TSHR (0.39) TDP1LMNACYP3A4KMT2ATSHR
SCHEMBL20338478 0.77 ALDH1A1 (0.33) TDP1LMNANAPRTTSHRACHE
SCHEMBL821938 0.77 ALDH1A1 (0.33) TDP1LMNANAPRTTSHRACHE
SCHEMBL28598523 0.77 ALDH1A1 (0.33) TDP1LMNANAPRTTSHRACHE
SCHEMBL30171495 0.77 ALDH1A1 (0.33) TDP1LMNANAPRTTSHRACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-210854661-U Rubberizing device 米亚索乐装备集成(福建)有限公司 2020-06-26 CN disclosed
US-8840986-B2 Laminate coated with radiation-hardenable printing ink or printing lacquer and moulded piece BAYER MATERIALSCIENCE AG (DE) 2014-09-23 US disclosed
US-8580878-B2 Radiation-curable printing ink or printing varnish MARABU GMBH & CO. KG (DE) 2013-11-12 US disclosed
US-20110118377-A1 RADIATION-CURABLE PRINTING INK OR PRINTING VARNISH MARABU GMBH & CO. KG (DE) 2011-05-19 US disclosed
US-20110117350-A1 LAMINATE COATED WITH RADIATION-HARDENABLE PRINTING INK OR PRINTING LACQUER AND MOULDED PIECE BAYER MATERIALSCIENCE AG 2011-05-19 US disclosed
US-7741635-B2 Composition for organic polymer gate insulating layer and organic thin film transistor using the same ELECTRONICS AND TELECOMMUNICATIONS RESEARCH INSTITUTE (KR) 2010-06-22 US disclosed
EP-2073288-A2 Composition for organic polymer gate insulating layer and organic thin film transistor using the same ELECTRONICS AND TELECOMMUNICATIONS RESEARCH INSTITUTE (KR) 2009-06-24 EP disclosed
US-20090152537-A1 COMPOSITION FOR ORGANIC POLYMER GATE INSULATING LAYER AND ORGANIC THIN FILM TRANSISTOR USING THE SAME ELECTRONICS AND TELECOMMUNICATIONS RESEARCH INSTITUTE (KR) 2009-06-18 US disclosed