SCHEMBL28179447

SCHEMBL28179447

COc1ccc(Cn2cccc2-c2ccc(OCc3ccccc3)cc2)cc1OC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ REV1 Q9UBZ9 1/20 0.50
▸ CSF1R P07333 2/20 0.49
▸ MAPK1 P28482 3/20 0.48
▸ NPC1 O15118 2/20 0.48
▸ RAB9A P51151 2/20 0.48
▸ HSD17B10 Q99714 1/20 0.48
▸ MAPT P10636 2/20 0.47
▸ ALDH1A1 P00352 2/20 0.47
▸ LMNA P02545 2/20 0.47
▸ ALOX12 P18054 1/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.47
▸ MEN1 O00255 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ ABCB1 P08183 1/20 0.44
▸ ABCG2 Q9UNQ0 1/20 0.44
▸ MMP1 P03956 1/20 0.43
▸ KDM4E B2RXH2 2/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ CYP3A4 P08684 1/20 0.43
▸ CYP2D6 P10635 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
SCHEMBL27992859 0.93 REV1 (0.53) REV1CSF1RMAPK1NPC1RAB9A
SCHEMBL28178663 0.89 MGAM (0.47) REV1ALDH1A1MEN1KMT2AABCB1
SCHEMBL28815504 0.87 CYP11B1 (0.51) REV1NPC1RAB9AALDH1A1MEN1
SCHEMBL28851823 0.87 CYP11B1 (0.51) REV1NPC1RAB9AALDH1A1MEN1
SCHEMBL28179455 0.86 MAOB (0.55) MAPTLMNAABCB1
SCHEMBL28179433 0.84 REV1 (0.50) REV1NPC1RAB9AMAPTALDH1A1
SCHEMBL28179445 0.84 MAPK14 (0.51) NPC1RAB9AMAPTALDH1A1LMNA
SCHEMBL27992857 0.84 L3MBTL1 (0.51) REV1ALDH1A1LMNAL3MBTL1MEN1
SCHEMBL28179451 0.83 TDP1 (0.47) REV1MAPTALDH1A1ALOX12L3MBTL1
SCHEMBL28178688 0.81 PDE4A (0.50) MAPTALDH1A1LMNAL3MBTL1MEN1

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-104370793-B Pyroles marine alkaloids Neolamellarin A analogs and its preparation method and application 中国海洋大学 2017-10-17 — — CN disclosed
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