SCHEMBL9738658

SCHEMBL9738658

CCC(C)(C)c1cc(Sc2ccc(O)c(C(C)(C)CC)c2)ccc1O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.38
ALOX15 P16050 4/20 0.38
HSD17B10 Q99714 2/20 0.38
NR1I2 O75469 1/20 0.38
LMNA P02545 1/20 0.38
CYP2C9 P11712 1/20 0.38
MIF P14174 1/20 0.38
TYR P14679 1/20 0.38
HTT P42858 1/20 0.38
NFE2L2 Q16236 1/20 0.38
ESR1 P03372 5/20 0.36
ESR2 Q92731 3/20 0.36
AR P10275 1/20 0.36
HSP90AA1 P07900 2/20 0.35
HSP90AB1 P08238 2/20 0.35
MCL1 Q07820 2/20 0.34
MAPT P10636 3/20 0.33
HPN P05981 1/20 0.33
SIRT5 Q9NXA8 1/20 0.33
BCL2 P10415 1/20 0.33

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
SCHEMBL316680 0.80 ALDH1A1 (0.59) ALDH1A1ALOX15HSD17B10NR1I2LMNA
SCHEMBL30026979 0.79 ALDH1A1 (0.63) ALDH1A1ALOX15HSD17B10NR1I2LMNA
SCHEMBL133971 0.79 ALDH1A1 (0.63) ALDH1A1ALOX15HSD17B10NR1I2LMNA
SCHEMBL80891 0.77 MAPK1 (0.48) ALDH1A1ALOX15HSD17B10NR1I2LMNA
SCHEMBL30135130 0.77 TRPA1 (0.46) ALDH1A1ALOX15HSD17B10NR1I2LMNA
SCHEMBL7597386 0.77 TRPA1 (0.46) ALDH1A1ALOX15HSD17B10NR1I2LMNA
SCHEMBL29481306 0.77 MAPK1 (0.48) ALDH1A1ALOX15HSD17B10NR1I2LMNA
SCHEMBL23964558 0.76 NR3C1 (0.43) ALDH1A1ALOX15HSD17B10NR1I2LMNA
Hydrochloric Acid SCHEMBL7076597 0.76 MAPK1 (0.47) ALDH1A1ALOX15HSD17B10NR1I2LMNA
SCHEMBL11518066 0.76 PRKCI (0.46) ALDH1A1ALOX15HSD17B10NR1I2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240043768-A1 PROCESS FOR PREPARING HOMO- AND COPOLYMERS OF ALKYL (METH)ACRYLATES WITH LOW RESIDUAL MONOMER CONTENT EVONIK OPERATIONS GMBH (DE) 2024-02-08 US disclosed
US-5167846-A Stabilizers for elastomers, lubricants or hydraulic fluids CIBA-GEIGY CORPORATION (US) 1992-12-01 US disclosed
EP-0004442-A1 Improved elastomeric ethylene/carboxylic acid copolymer, a process for its preparation; vulcanizable compositions containing the copolymer and vulcanized articles prepared therefrom E.I. DU PONT DE NEMOURS AND COMPANY (US) 1979-10-03 EP disclosed