SCHEMBL1480784

SCHEMBL1480784

COc1ccc(-c2cc3c(cc2C(C)(C)C)-c2cc(C(C)(C)C)ccc2C3)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 1/20 0.36
ABL1 P00519 1/20 0.36
ABCB1 P08183 1/20 0.36
BCR P11274 1/20 0.36
MAPT P10636 3/20 0.35
ALDH1A1 P00352 4/20 0.35
HPGD P15428 2/20 0.35
KDM4E B2RXH2 2/20 0.35
PTGDR2 Q9Y5Y4 1/20 0.35
ACHE P22303 1/20 0.35
BACE1 P56817 1/20 0.35
ADORA1 P30542 1/20 0.35
METAP1 P53582 1/20 0.35
LMNA P02545 1/20 0.35
ALOX15 P16050 1/20 0.35
APEX1 P27695 1/20 0.35
MAPK1 P28482 1/20 0.35
RECQL P46063 1/20 0.35
HSD17B10 Q99714 1/20 0.35
TDP1 Q9NUW8 1/20 0.35

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
SCHEMBL1482711 0.92 ABL1 (0.41) ABL1ABCB1BCRMAPTALDH1A1
SCHEMBL1481315 0.85 TDP2 (0.40) BACE1
SCHEMBL312040 0.84 KIF11 (0.41) MAPTALDH1A1KDM4ELMNA
SCHEMBL1481324 0.83 NPC1 (0.37) ALDH1A1BACE1
SCHEMBL1480162 0.83 GCGR (0.40) MAPTALDH1A1MAPK1
SCHEMBL1479601 0.78 TDP2 (0.43) BACE1
SCHEMBL1480786 0.77 NPC1 (0.51) MAPTALDH1A1KDM4EPTGDR2LMNA
SCHEMBL29471001 0.75 ALDH1A1 (0.45) MAPTALDH1A1HPGDLMNAALOX15
SCHEMBL311978 0.75 ALDH1A1 (0.45) MAPTALDH1A1HPGDLMNAALOX15
SCHEMBL4954208 0.75 ESR1 (0.36) MAPTALDH1A1METAP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8293856-B2 Process for preparing olefin polymer using mixed catalyst MITSUI CHEMICALS, INC. (JP) 2012-10-23 US disclosed
US-20110077369-A1 PROCESS FOR PREPARING OLEFIN POLYMER USING MIXED CATALYST MITSU CHEMICALS, INC. 2011-03-31 US disclosed