SCHEMBL9350253

SCHEMBL9350253

CC(C)(C)c1ccc2c(ccc3c(C4=CC(=O)C=CC4=O)c(C(C)(C)C)ccc32)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1I2 O75469 1/20 0.44
CCR6 P51684 1/20 0.34
HKDC1 Q2TB90 1/20 0.34
MEN1 O00255 2/20 0.32
MAPK1 P28482 2/20 0.32
KMT2A Q03164 2/20 0.32
USP2 O75604 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
TP53 P04637 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
HPGD P15428 1/20 0.32
ALOX12 P18054 1/20 0.32
CYP2C19 P33261 1/20 0.32
HIF1A Q16665 1/20 0.32
KDM4E B2RXH2 1/20 0.31
MAPT P10636 1/20 0.31
PKM P14618 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
Benzoquinone SCHEMBL10586825 0.77 NR1I2 (0.49) NR1I2MEN1MAPK1KMT2AALDH1A1
SCHEMBL13727573 0.71 MAOA (0.46) CCR6HKDC1MEN1MAPK1KMT2A
SCHEMBL3290538 0.68 CCR6 (0.37) CCR6HKDC1MEN1MAPK1KMT2A
SCHEMBL7918755 0.68 MEN1 (0.35) CCR6HKDC1MEN1MAPK1KMT2A
SCHEMBL28583375 0.68 MAPT (0.47) HKDC1MEN1MAPK1KMT2AALDH1A1
SCHEMBL29214642 0.67 CCR6 (0.40) CCR6HKDC1MEN1MAPK1KMT2A
SCHEMBL11577947 0.66 CYP1A2 (0.53) CCR6HKDC1MEN1MAPK1KMT2A
Dibunic Acid SCHEMBL143895 0.65 NR1I2 (0.71) NR1I2MEN1KMT2AALDH1A1CYP1A2
Dibunic Acid SCHEMBL30080770 0.65 NR1I2 (0.71) NR1I2MEN1KMT2AALDH1A1CYP1A2
SCHEMBL6665985 0.65 ALDH1A1 (0.48) CCR6HKDC1MEN1MAPK1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0343666-B1 Correct-reading images from photopolymer electrographic master DU PONT (US) 1994-08-03 EP disclosed
EP-0390103-A2 High resolution superimposed images from photopolymer electrographic master E.I. DU PONT DE NEMOURS AND COMPANY (US) 1990-10-03 EP disclosed
US-4960660-A RADIATION EXPOSURE, STRIPPING COVER SHEET, LAMINATION, PEELING TEMPORARY SURFACE, CHARGING, DEVELOPING E. I. DU PONT DE NEMOURS AND COMPANY (US) 1990-10-02 US disclosed
US-4897327-A Correct-reading images from photopolymer electrographic master E. I. DU PONT DE NEMOURS AND COMPANY (US) 1990-01-30 US disclosed
EP-0343666-A2 Correct-reading images from photopolymer electrographic master E.I. DU PONT DE NEMOURS AND COMPANY (US) 1989-11-29 EP disclosed
EP-0315120-A2 Photohardenable electrostatic master having improved backtransfer and charge decay E.I. DU PONT DE NEMOURS AND COMPANY (US) 1989-05-10 EP disclosed
EP-0315116-A2 Photohardenable electrostatic master containing electron acceptor or donor E.I. DU PONT DE NEMOURS AND COMPANY (US) 1989-05-10 EP disclosed
US-4818660-A POLYMERIC BINDER AND UNSATURATED COMPOUND, PHOTOINITIATOR, BAS IC DYE, LEUCO DYE AND STRONG ACID E. I. DU PONT DE NEMOURS AND COMPANY (US) 1989-04-04 US disclosed
US-4269933-A PHOTOLITHOGRAPHY; POSITIVE AND NEGATIVE IMAGES; POLYMERIZATION OF A UNSATURATED POLYESTER USING A PHOTOSENSITIVE FREE RADICAL SYSTEM E. I. DU PONT DE NEMOURS AND COMPANY (US) 1981-05-26 US disclosed
US-4198242-A Photopolymerizable composition containing an o-nitroaromatic compound as photoinhibitor E. I. DU PONT DE NEMOURS AND COMPANY (US) 1980-04-15 US disclosed
US-4168981-A Bis(substituted amino)sulfides as reversible inhibitor sources for photopolymerization E. I. DU PONT DE NEMOURS AND COMPANY (US) 1979-09-25 US disclosed
US-4029505-A PHOTOPOLYMERIZABLE LAYER OF UNSATURATED COMPOUND, DINITROSO COMPOUND, AND FREE-RADICAL GENERATOR E. I. DU PONT DE NEMOURS AND COMPANY (US) 1977-06-14 US disclosed