SCHEMBL18230815

SCHEMBL18230815

CCC(O)COc1ccc(C2(c3ccc(OCC4CO4)cc3)CC(C)CC(C)(C)C2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 1/20 0.46
▸ ESR2 Q92731 1/20 0.46
▸ TSHR P16473 4/20 0.41
▸ MEN1 O00255 4/20 0.41
▸ KMT2A Q03164 4/20 0.41
▸ ALDH1A1 P00352 4/20 0.41
▸ TP53 P04637 3/20 0.41
▸ HPGD P15428 3/20 0.41
▸ MAPT P10636 2/20 0.41
▸ HIF1A Q16665 2/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ PPARG P37231 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.36
▸ PKM P14618 2/20 0.36
▸ GAA P10253 2/20 0.36
▸ LMNA P02545 1/20 0.36
▸ CASP2 P42575 1/20 0.35
▸ KDM4E B2RXH2 2/20 0.35
▸ CYP3A4 P08684 1/20 0.33
▸ SMN1; SMN2 Q16637 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
SCHEMBL17467601 0.95 ESR1 (0.49) ESR1ESR2TSHRMEN1KMT2A
SCHEMBL18932143 0.88 ESR1 (0.55) ESR1ESR2TSHRMEN1KMT2A
SCHEMBL22971495 0.87 ESR1 (0.50) ESR1ESR2TSHRMEN1KMT2A
SCHEMBL18230813 0.83 PKM (0.51) ESR1ESR2TSHRMEN1KMT2A
SCHEMBL21672948 0.81 ESR1 (0.48) ESR1ESR2TSHRMEN1KMT2A
SCHEMBL18230811 0.81 HPGD (0.42) TSHRMEN1KMT2AALDH1A1TP53
SCHEMBL18942127 0.80 ESR1 (0.46) ESR1ESR2TSHRMEN1KMT2A
SCHEMBL12009483 0.80 TDP1 (0.45) TSHRMEN1KMT2AALDH1A1TP53
SCHEMBL17635579 0.78 ALDH1A1 (0.50) TSHRMEN1KMT2AALDH1A1TP53
SCHEMBL11896707 0.76 ALDH1A1 (0.72) TSHRMEN1KMT2AALDH1A1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9493651-B2 Halogen-free resin composition, and prepreg and laminate for printed circuits using the same SHENGYI TECHNOLOGY CO., LTD. (CN) 2016-11-15 — — US disclosed
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