SCHEMBL11279550

SCHEMBL11279550

CC(C)(C)c1cc(C(C(=O)O)c2ccc(O)c(C(C)(C)C)c2)ccc1O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.50
ALOX15 P16050 2/20 0.50
NR1I2 O75469 1/20 0.50
LMNA P02545 1/20 0.50
CYP2C9 P11712 1/20 0.50
MIF P14174 1/20 0.50
TYR P14679 1/20 0.50
HTT P42858 1/20 0.50
NFE2L2 Q16236 1/20 0.50
HSD17B10 Q99714 1/20 0.50
RARB P10826 2/20 0.45
RARG P13631 2/20 0.45
HSP90AA1 P07900 5/20 0.44
HSP90AB1 P08238 5/20 0.44
KDM4E B2RXH2 1/20 0.43
CYP1A2 P05177 1/20 0.43
MAPT P10636 1/20 0.43
ATP2A2 P16615 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
ATP2A3 Q93084 1/20 0.43

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
SCHEMBL29690266 1.00 ALDH1A1 (0.50) ALDH1A1ALOX15NR1I2LMNACYP2C9
Butyramide SCHEMBL29268236 0.86 HSP90AA1 (0.41) ALDH1A1ALOX15NR1I2LMNACYP2C9
SCHEMBL8987791 0.84 BLM (0.57) ALDH1A1ALOX15NR1I2LMNACYP2C9
SCHEMBL8088962 0.84 BLM (0.57) ALDH1A1ALOX15NR1I2LMNACYP2C9
SCHEMBL7633340 0.84 NR1I2 (0.48) ALDH1A1ALOX15NR1I2LMNACYP2C9
SCHEMBL5291906 0.83 ALDH1A1 (0.58) ALDH1A1ALOX15NR1I2LMNACYP2C9
Ethylene SCHEMBL28950919 0.81 AKR1C3 (0.46) ALDH1A1ALOX15NR1I2LMNACYP2C9
SCHEMBL7768343 0.80 AKR1C3 (0.51) ALDH1A1ALOX15NR1I2LMNACYP2C9
Terbuficin SCHEMBL2110504 0.79 GLRA3 (0.52) ALDH1A1ALOX15LMNATYRHTT
SCHEMBL28422457 0.79 ALDH1A1 (0.47) ALDH1A1ALOX15NR1I2LMNACYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4007282-A Lowering lipid and sugar levels in the blood with a bis(4-hydroxyphenyl)alkanoic acid or ester thereof HOECHST AKTIENGESELLSCHAFT (DT) 1977-02-08 US claimed
EP-0019103-B1 EPOXIDE RESINS CONTAINING PHENOL GROUPS, THEIR USE AND PLASTICS COMPOSITIONS CONTAINING THEM HOECHST AKTIENGESELLSCHAFT (DE) 1982-12-22 EP disclosed
US-4308195-A HEAT AND LIGHT STABILIZERS HOECHST AKTIENGESELLSCHAFT (DE) 1981-12-29 US disclosed
EP-0004331-B1 GLYCEROL PHOSPHITES ESTERIFIED WITH PHENOLCARBOXYLIC ACIDS, THEIR PREPARATION AND USE AS STABILIZERS FOR SYNTHETIC MATERIALS HOECHST AKTIENGESELLSCHAFT (DE) 1981-05-13 EP disclosed
EP-0019103-A1 Epoxide resins containing phenol groups, their use and plastics compositions containing them HOECHST AKTIENGESELLSCHAFT (DE) 1980-11-26 EP disclosed
US-4229382-A STABILIZERS FOR POLYOLEFINS HOECHST AKTIENGESELLSCHAFT (DE) 1980-10-21 US disclosed
EP-0004331-A2 Glycerol phosphites esterified with phenolcarboxylic acids, their preparation and use as stabilizers for synthetic materials HOECHST AKTIENGESELLSCHAFT (DE) 1979-10-03 EP disclosed
US-4007282-A Lowering lipid and sugar levels in the blood with a bis(4-hydroxyphenyl)alkanoic acid or ester thereof HOECHST AKTIENGESELLSCHAFT (DT) 1977-02-08 US disclosed