SCHEMBL7944987

SCHEMBL7944987

CC(C)(C)c1cc(COCCO)cc(C(C)(C)C)c1O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.51
MAPT P10636 5/20 0.51
TSHR P16473 4/20 0.51
KDM4E B2RXH2 4/20 0.51
MAPK1 P28482 3/20 0.51
LMNA P02545 3/20 0.51
GSR P00390 2/20 0.51
HPGD P15428 2/20 0.51
MEN1 O00255 2/20 0.51
CYP1A2 P05177 2/20 0.51
CYP3A4 P08684 2/20 0.51
BLM P54132 2/20 0.51
KMT2A Q03164 2/20 0.51
ATM Q13315 2/20 0.51
HIF1A Q16665 2/20 0.51
NPSR1 Q6W5P4 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
ALOX15 P16050 2/20 0.51
GMNN O75496 1/20 0.51
GABBR2 O75899 1/20 0.51

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
SCHEMBL11650738 0.91 ALDH1A1 (0.53) ALDH1A1MAPTTSHRKDM4EMAPK1
SCHEMBL7940460 0.90 CYP1A2 (0.47) ALDH1A1MAPTTSHRKDM4EMAPK1
SCHEMBL7941099 0.90 ALDH1A1 (0.49) ALDH1A1MAPTTSHRKDM4EMAPK1
SCHEMBL7941416 0.88 ALDH1A1 (0.47) ALDH1A1MAPTTSHRKDM4EMAPK1
SCHEMBL39028 0.87 ALDH1A1 (0.57) ALDH1A1MAPTTSHRKDM4EMAPK1
SCHEMBL9486485 0.85 ALDH1A1 (0.55) ALDH1A1MAPTTSHRKDM4EMAPK1
SCHEMBL4141395 0.85 ALDH1A1 (0.43) ALDH1A1MAPTTSHRKDM4EMAPK1
SCHEMBL14571974 0.84 ALDH1A1 (0.47) ALDH1A1MAPTTSHRKDM4EMAPK1
SCHEMBL2679983 0.83 ALDH1A1 (0.46) ALDH1A1MAPTTSHRKDM4EMAPK1
SCHEMBL7940053 0.83 DHFR (0.40) ALDH1A1MAPTTSHRKDM4EMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6242514-B1 CYCLIC PHOSPHATE OR PHOSPHONATE; HEAT AND OXIDATION STABILIZER ESPECIALLY FOR OLEFIN POLYMERS AND ENGINEERING THERMOPLASTICS SUMITOMO CHEMICAL COMPANY, LTD. (JP) 2001-06-05 US disclosed
US-5914361-A IMPART HEAT STABILITY TO ORGANIC MATERIALS, INCLUDING POLYOLEFINS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-06-22 US disclosed
US-5874494-A DETERIORATION STABILIZER FOR THERMOPLASTIC RESIN; OXIDATION RESISTANCE, DISCOLORATION INHIBITION, HEAT RESISTANCE, CROSSLINKING INHIBITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-02-23 US disclosed
US-4117240-A CONTAINING ANTIOXIDANT PHENOLIC DERIVATIVES OF ACRYLIC ESTERS AS MONOMERS THE GOODYEAR TIRE & RUBBER COMPANY (US) 1978-09-26 US disclosed
US-3962187-A STABILIZED POLYMERS OF DITERTIARY ALKYL-4-HYDROXYBENZYLOXY ALKYL ACRYLATES AND DIENES THE GOODYEAR TIRE & RUBBER COMPANY (US) 1976-06-08 US disclosed