SCHEMBL8356247

SCHEMBL8356247

COc1ccc2c([c]c(C)n2C(=O)CCc2ccccc2)c1C(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 4/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ PTGDR2 Q9Y5Y4 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ NPC1 O15118 4/20 0.37
▸ RAB9A P51151 3/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ AKR1C3 P42330 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.34

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
SCHEMBL8353882 0.81 CYP1A2 (0.38) SMN1; SMN2KMT2ANPC1RAB9AMEN1
SCHEMBL8358773 0.73 CNR2 (0.44) ALOX5L3MBTL1PTGDR2KMT2ARAB9A
SCHEMBL7970472 0.63 SRC (0.55) ALOX5L3MBTL1SMN1; SMN2KMT2ANPC1
SCHEMBL13777343 0.63 MEN1 (0.55) KMT2ANPC1RAB9AMEN1LMNA
SCHEMBL8353820 0.62 SIGMAR1 (0.43) —
SCHEMBL30306293 0.61 MEN1 (0.66) L3MBTL1SMN1; SMN2PTGDR2KMT2ANPC1
SCHEMBL5598351 0.59 ALDH1A1 (0.61) L3MBTL1SMN1; SMN2KMT2ANPC1RAB9A
SCHEMBL20940489 0.59 ALOX5 (1.00) ALOX5KMT2A
SCHEMBL6203601 0.59 ABCB1 (0.62) ALOX5KMT2ANPC1RAB9AMEN1
SCHEMBL28283295 0.59 AKR1C3 (0.64) ALOX5L3MBTL1KMT2ANPC1RAB9A

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-5877202-A Indole derivatives useful to treat estrogen-related neoplasms and disorders AVENTISUB II INC. 1999-03-02 — — US disclosed
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