SCHEMBL27892893

SCHEMBL27892893

CC(C)(C)c1ccc(O)c(C(C)(C)C)c1.CC(C)(C)c1ccc(O)c(C(C)(C)C)c1.OP(O)Oc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.43
▸ ALOX15 P16050 3/20 0.43
▸ HSD17B10 Q99714 2/20 0.43
▸ TDP1 Q9NUW8 2/20 0.43
▸ HPGD P15428 1/20 0.43
▸ CYP2C9 P11712 2/20 0.42
▸ NR1I2 O75469 1/20 0.42
▸ LMNA P02545 1/20 0.42
▸ MIF P14174 1/20 0.42
▸ TYR P14679 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ NFE2L2 Q16236 1/20 0.42
▸ CYP2D6 P10635 2/20 0.41
▸ TSHR P16473 3/20 0.41
▸ MAPT P10636 4/20 0.40
▸ GAA P10253 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ PKM P14618 1/20 0.40
▸ RECQL P46063 1/20 0.40
▸ KMT2A Q03164 1/20 0.40

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
Biphenyl SCHEMBL29547085 0.84 ALDH1A1 (0.44) ALDH1A1ALOX15HSD17B10TDP1HPGD
SCHEMBL29431941 0.82 ALDH1A1 (0.53) ALDH1A1ALOX15HSD17B10TDP1HPGD
Benzene SCHEMBL28155736 0.82 ALDH1A1 (0.61) ALDH1A1ALOX15HSD17B10TDP1HPGD
SCHEMBL28281035 0.82 ALDH1A1 (0.46) ALDH1A1ALOX15HSD17B10TDP1HPGD
Biphenyl SCHEMBL31621723 0.81 ALDH1A1 (0.48) ALDH1A1ALOX15HSD17B10TDP1HPGD
SCHEMBL597699 0.81 ALDH1A1 (0.59) ALDH1A1ALOX15HSD17B10TDP1HPGD
SCHEMBL8845948 0.81 ALDH1A1 (0.59) ALDH1A1ALOX15HSD17B10TDP1HPGD
SCHEMBL1134579 0.81 ALDH1A1 (0.59) ALDH1A1ALOX15HSD17B10TDP1HPGD
SCHEMBL28548149 0.80 ALDH1A1 (0.47) ALDH1A1ALOX15HSD17B10TDP1HPGD
SCHEMBL28433547 0.79 ALDH1A1 (0.56) ALDH1A1ALOX15HSD17B10CYP2C9NR1I2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102964631-B Antioxidant di(2, 4-di-tert-butylphenol) phenylphosphite and preparation method as well as application thereof UNIV SHANDONG SCIENCE & TECH 2014-06-11 — — CN disclosed
CN-102964631-B Antioxidant di(2, 4-di-tert-butylphenol) phenylphosphite and preparation method as well as application thereof UNIV SHANDONG SCIENCE & TECH 2014-06-11 — — CN disclosed
CN-102964631-A Antioxidant di(2, 4-di-tert-butylphenol) phenylphosphite and preparation method as well as application thereof UNIV SHANDONG SCIENCE & TECH 2013-03-13 — — CN disclosed
CN-102964631-A Antioxidant di(2, 4-di-tert-butylphenol) phenylphosphite and preparation method as well as application thereof UNIV SHANDONG SCIENCE & TECH 2013-03-13 — — CN disclosed
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