SCHEMBL8201116

SCHEMBL8201116

CC(O)Oc1ccccc1.CCC(O)Oc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.46
MTNR1A P48039 1/20 0.41
MTNR1B P49286 1/20 0.41
MAPT P10636 1/20 0.40
TRPA1 O75762 1/20 0.39
ADRB2 P07550 1/20 0.38
ADRB1 P08588 1/20 0.38
CYP2D6 P10635 1/20 0.38
ADRB3 P13945 1/20 0.38
ALDH1A1 P00352 2/20 0.37
TSHR P16473 1/20 0.37
CYP1A2 P05177 1/20 0.37
GAA P10253 1/20 0.37
CYP2C9 P11712 1/20 0.37
PKM P14618 1/20 0.37
CYP2C19 P33261 1/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
ANPEP P15144 1/20 0.36
LAP3 P28838 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
SCHEMBL50191 0.92 LMNA (0.47) LMNAMTNR1AMTNR1BMAPTTRPA1
Hydrochloric Acid SCHEMBL28208616 0.90 LMNA (0.45) LMNAMTNR1AMTNR1BMAPTTRPA1
Alcohol SCHEMBL4086513 0.86 LMNA (0.50) LMNAMTNR1AMTNR1BMAPTTRPA1
Benzene SCHEMBL28097669 0.85 LMNA (0.52) LMNAMTNR1AMTNR1BADRB2ADRB1
SCHEMBL15709 0.85 LMNA (0.52) LMNAMTNR1AMTNR1BADRB2ADRB1
SCHEMBL167127 0.85 LMNA (0.52) LMNAMTNR1AMTNR1BADRB2ADRB1
SCHEMBL14880143 0.83 LMNA (0.50) LMNAMTNR1AMTNR1BADRB2ADRB1
Methyl Alcohol SCHEMBL7078021 0.83 LMNA (0.50) LMNAMTNR1AMTNR1BADRB2ADRB1
SCHEMBL28824443 0.83 LMNA (0.50) LMNAMTNR1AMTNR1BADRB2ADRB1
Hydrochloric Acid SCHEMBL12613519 0.83 LMNA (0.50) LMNAMTNR1AMTNR1BADRB2ADRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3191895-B1 METHOD FOR MAKING LITHOGRAPHIC PRINTING PLATES EASTMAN KODAK CO (US) 2018-06-27 EP disclosed
EP-3191895-A1 METHOD FOR MAKING LITHOGRAPHIC PRINTING PLATES Eastman Kodak Company (US) 2017-07-19 EP disclosed
US-9329485-B2 Method for making lithographic printing plates EASTMAN KODAK COMPANY (US) 2016-05-03 US disclosed
US-20160077437-A1 METHOD FOR MAKING LITHOGRAPHIC PRINTING PLATES BANK OF AMERICA, N.A. 2016-03-17 US disclosed
US-6126930-A REDUCING TRIGEMINAL STIMULATION FROM AN ATOMIZED ALCOHOL THE PROCTER & GAMBLE COMPANY (US) 2000-10-03 US disclosed
US-5972361-A USEFUL FOR BOTH CLEANSING AND CONDITIONING THE SKIN OR HAIR; COMPRISINGWATER INSOLUBLE SUBSTRATE, LATHERING SURFACTANT, AND OIL SOLUBLE CONDITIONING AGENT THE PROCTER & GAMBLE COMPANY (US) 1999-10-26 US disclosed