SCHEMBL6937277

SCHEMBL6937277

CC(C)(C)c1ccc(C(=O)c2ccc(C(C)(C)C)cc2C(Cl)(Cl)Cl)c(C(Cl)(Cl)Cl)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.46
ALDH1A1 P00352 3/20 0.39
HPGD P15428 1/20 0.39
ALOX15 P16050 1/20 0.39
HSD17B10 Q99714 1/20 0.39
SRD5A2 P31213 1/20 0.39
SIRT1 Q96EB6 1/20 0.39
HSP90AA1 P07900 1/20 0.38
HSP90AB1 P08238 1/20 0.38
CES2 O00748 1/20 0.38
NR1H4 Q96RI1 2/20 0.37
CYP2C19 P33261 1/20 0.37
AKR1C2 P52895 1/20 0.36
AKR1C1 Q04828 1/20 0.36
MEN1 O00255 1/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
PKM P14618 1/20 0.36
RECQL P46063 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL31350139 0.86 TDP1 (0.50) TDP1ALDH1A1HPGDALOX15HSD17B10
SCHEMBL19398282 0.79 ALDH1A1 (0.50) TDP1ALDH1A1HPGDALOX15HSD17B10
SCHEMBL17998017 0.76 TDP1 (0.56) TDP1ALDH1A1HPGDALOX15HSD17B10
SCHEMBL28432778 0.76 TDP1 (0.44) TDP1ALDH1A1HPGDALOX15HSD17B10
SCHEMBL28750425 0.75 TDP1 (0.59) TDP1ALDH1A1HPGDALOX15HSD17B10
SCHEMBL3367799 0.75 ALDH1A1 (0.43) TDP1ALDH1A1HPGDALOX15HSD17B10
SCHEMBL4631399 0.75 TDP1 (0.59) TDP1ALDH1A1HPGDALOX15HSD17B10
SCHEMBL4850025 0.73 CES2 (0.40) ALDH1A1HPGDALOX15HSD17B10CES2
SCHEMBL27888034 0.73 TDP1 (0.57) TDP1ALDH1A1HPGDALOX15HSD17B10
SCHEMBL27923138 0.73 TDP1 (0.57) TDP1ALDH1A1HPGDALOX15HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11542393-B2 Radiation curable polyurethane resin for ink jet ink AGFA NV (BE) 2023-01-03 US disclosed
US-20200369880-A1 RADIATION CURABLE POLYURETHANE RESIN FOR INK JET INK AGFA NV (BE) 2020-11-26 US disclosed
CN-111406081-A Radiation curable polyurethane resins for inkjet inks 爱克发有限公司 2020-07-10 CN disclosed
WO-2020064633-A1 LASER MARKABLE COMPOSITIONS AGFA NV (BE) 2020-04-02 WO disclosed
EP-3626471-A1 LASER MARKABLE COMPOSITIONS AGFA NV (BE) 2020-03-25 EP disclosed
EP-0828195-B1 Method for improving photoimage quality CIBA SC HOLDING AG (CH) 2003-02-19 EP disclosed
EP-1177478-A1 PHOTOSENSITIVE COMPOSITION Ciba SC Holding AG (CH) 2002-02-06 EP disclosed
WO-2000068739-A1 PHOTOSENSITIVE COMPOSITION VANTICO AG (CH) 2000-11-16 WO disclosed
US-6045972-A APPLYING A PHOTOCHEMICALLY OR THERMALLY CURABLE EPOXY ACRYLATE RESIN TO FORM A NON-TACKY AND GOOD EDGE COVERINGS; WATERPROOFING CIBA SPECIALTY CHEMICALS CORP. (US) 2000-04-04 US disclosed
US-5942371-A Aqueous acrylic photopolymerisable compositions CIBA SPECIALTY CHEMICALS CORP. (US) 1999-08-24 US disclosed
EP-0828195-A2 Method for improving photoimage quality Ciba SC Holding AG (CH) 1998-03-11 EP disclosed