SCHEMBL3187828

SCHEMBL3187828

CCOc1cc(N(CC)CC)ccc1C1(c2c(C)n(CC)c3ccccc23)OC(=O)c2nccnc21

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.36
ALDH1A1 P00352 5/20 0.35
GSK3A P49840 1/20 0.33
GSK3B P49841 1/20 0.33
TP53 P04637 5/20 0.33
THRB P10828 2/20 0.33
LMNA P02545 3/20 0.32
HTT P42858 1/20 0.32
HPGD P15428 1/20 0.32
POLB P06746 2/20 0.31
TSHR P16473 2/20 0.31
MAPT P10636 3/20 0.31
PKM P14618 1/20 0.31
MEN1 O00255 1/20 0.30
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
KMT2A Q03164 1/20 0.30
NPY5R Q15761 1/20 0.30

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
SCHEMBL30154381 1.00 SMN1; SMN2 (0.36) SMN1; SMN2ALDH1A1GSK3AGSK3BTP53
SCHEMBL8024221 0.93 SMN1; SMN2 (0.35) SMN1; SMN2ALDH1A1GSK3AGSK3BTP53
SCHEMBL29735694 0.91 GSK3A (0.36) SMN1; SMN2ALDH1A1GSK3AGSK3BTP53
SCHEMBL211485 0.91 GSK3A (0.36) SMN1; SMN2ALDH1A1GSK3AGSK3BTP53
SCHEMBL30792926 0.91 CNR2 (0.40) ALDH1A1HTTMEN1KMT2A
SCHEMBL10594124 0.91 CNR2 (0.40) ALDH1A1HTTMEN1KMT2A
SCHEMBL3187819 0.91 CNR2 (0.40) ALDH1A1HTTMEN1KMT2A
SCHEMBL10595719 0.91 CNR2 (0.40) ALDH1A1HTTMEN1KMT2A
SCHEMBL10934926 0.90 GSK3A (0.33) SMN1; SMN2ALDH1A1GSK3AGSK3BTP53
SCHEMBL30122739 0.89 SMN1; SMN2 (0.35) SMN1; SMN2ALDH1A1GSK3AGSK3BTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117677502-A Lithographic printing plate precursors and methods of use 伊斯曼柯达公司 2024-03-08 CN disclosed
US-20230091079-A1 LITHOGRAPHIC PRINTING PLATE PRECURSOR AND METHOD OF USE BANK OF AMERICA, AS AGENT 2023-03-23 US disclosed
US-9834022-B2 Thermal recording material MITSUBISHI PAPER MILLS LIMITED (JP) 2017-12-05 US disclosed
EP-3031611-B1 THERMAL RECORDING MATERIAL MITSUBISHI PAPER MILLS LTD (JP) 2017-09-27 EP disclosed
US-20160332469-A1 THERMAL RECORDING MATERIAL MITSUBISHI PAPER MILLS LIMITED (JP) 2016-11-17 US disclosed
EP-3031611-A1 THERMAL RECORDING MATERIAL Mitsubishi Paper Mills Limited (JP) 2016-06-15 EP disclosed
EP-2096149-B1 INK FOR SCRATCH COLORING AND SHEET WITH INVISIBLE INFORMATION PRINTED MITSUBISHI PAPER MILLS LTD (JP) 2014-10-22 EP disclosed
US-8288313-B2 Thermal recording material MITSUBISHI PAPER MILLS LIMITED (JP) 2012-10-16 US disclosed
US-8283285-B2 Scratch color-developable ink and invisible information printed sheet MITSUBISHI PAPER MILLS LIMITED (JP) 2012-10-09 US disclosed
US-20100069240-A1 THERMAL RECORDING MATERIAL MITSUBISHI PAPER MILLS LIMITED (JP) 2010-03-18 US disclosed
US-20100021702-A1 SCRATCH COLOR-DEVELOPABLE INK AND INVISIBLE INFORMATION PRINTED SHEET MITSUBISHI PAPER INK MFG. CO., LTD. (JP) 2010-01-28 US disclosed
EP-2096149-A1 INK FOR SCRATCH COLORING AND SHEET WITH INVISIBLE INFORMATION PRINTED Mitsubishi Paper Mills Limited (JP) 2009-09-02 EP disclosed
US-6960553-B2 Heat-sensitive recording material MITSUBISHI PAPER MILLS LTD. (JP) 2005-11-01 US disclosed
US-20030186810-A1 Heat-sensitive recording material MITSUBISHI PAPER MILLS LTD. 2003-10-02 US disclosed
US-6596669-B1 Comprising a support and two reversible heat-sensitive recording layers having different colors formed on the same side of the support, comprising colorless electron-donative dye precursor and an electron-accepting compound MITSUBISHI PAPER MILLS LIMITED (JP) 2003-07-22 US disclosed
US-6184180-B1 COMPRISES SUPPORT, REVERSIBLE HEAT-SENSITIVE RECORDING LAYER CONTAINING DYE PRECURSOR WHICH IS COLORLESS OR A PALE COLOR, COLOR DEVELOPER CAPABLE OF CAUSING REVERSIBLE CHANGE IN COLOR DENSITY OF DYE DUE TO DIFFERENCE IN COOLING RATE MITSUBISHI PAPER MILLS LIMITED (JP) 2001-02-06 US disclosed