SCHEMBL28415328

SCHEMBL28415328

CC(=O)Oc1cc(Br)cc(-c2ccccc2O)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 3/20 0.48
▸ CYP3A4 P08684 1/20 0.41
▸ RORC P51449 1/20 0.39
▸ RORB Q92753 1/20 0.39
▸ ELANE P08246 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ ALDH1A1 P00352 3/20 0.38
▸ HSD17B10 Q99714 2/20 0.38
▸ HPGD P15428 1/20 0.38
▸ BCL2L1 Q07817 1/20 0.38
▸ NPC1 O15118 2/20 0.37
▸ POLB P06746 1/20 0.37
▸ ESR2 Q92731 1/20 0.37
▸ MAPT P10636 4/20 0.37
▸ GAA P10253 2/20 0.37
▸ KDM4E B2RXH2 2/20 0.37
▸ TP53 P04637 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ CFD P00746 1/20 0.36

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
SCHEMBL28418983 0.83 BACE1 (0.46) BACE1LMNAALDH1A1HSD17B10HPGD
SCHEMBL27999721 0.80 CYP3A4 (0.57) BACE1CYP3A4LMNAALDH1A1HSD17B10
SCHEMBL3453107 0.75 LMNA (0.50) BACE1CYP3A4ELANELMNAALDH1A1
SCHEMBL14710190 0.75 LMNA (0.46) BACE1CYP3A4ELANELMNAALDH1A1
SCHEMBL28414986 0.73 EGFR (0.50) LMNAALDH1A1HPGDPOLBMAPT
SCHEMBL5534885 0.73 LMNA (0.45) BACE1CYP3A4ELANELMNAALDH1A1
SCHEMBL9780981 0.72 CFD (0.55) BACE1CYP3A4ELANELMNAHSD17B10
SCHEMBL27725727 0.72 CYP3A4 (0.53) BACE1CYP3A4ELANELMNAHSD17B10
SCHEMBL28409543 0.72 ALDH1A1 (0.47) CYP3A4LMNAALDH1A1HSD17B10HPGD
SCHEMBL27935472 0.71 BACE1 (0.70) BACE1CYP3A4ELANELMNAALDH1A1

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
CN-108101845-B Preparation method of eltrombopag 苏州科伦药物研究有限公司 2020-05-15 — — CN disclosed
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