SCHEMBL27760661

SCHEMBL27760661

CCC(C)(C)c1ccc(OC=O)cc1

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 2/20 0.53
▸ RAB9A P51151 2/20 0.53
▸ MAPT P10636 1/20 0.53
▸ ALDH1A1 P00352 1/20 0.44
▸ POLB P06746 1/20 0.44
▸ CYP2C9 P11712 1/20 0.44
▸ HRH3 Q9Y5N1 14/20 0.43
▸ MAOB P27338 9/20 0.43
▸ TDP1 Q9NUW8 1/20 0.40

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
Tert-Amylbenzene SCHEMBL27800283 0.87 NPC1 (0.44) NPC1RAB9AMAPTALDH1A1POLB
SCHEMBL9555577 0.83 CYP3A4 (0.53) NPC1RAB9AMAPTALDH1A1HRH3
SCHEMBL7590568 0.79 HPGD (0.41) MAPTALDH1A1POLBTDP1
SCHEMBL79678 0.79 CA1 (0.48) NPC1RAB9AMAPTALDH1A1MAOB
SCHEMBL27746848 0.79 NPC1 (0.43) NPC1RAB9AMAPTALDH1A1POLB
SCHEMBL10625431 0.78 NPC1 (0.50) NPC1RAB9AMAPTALDH1A1HRH3
SCHEMBL28774589 0.78 CA1 (0.47) NPC1RAB9AMAPTALDH1A1MAOB
SCHEMBL12352703 0.78 ALDH1A1 (0.34) NPC1RAB9AMAPTALDH1A1POLB
SCHEMBL13184097 0.78 ESR1 (0.43) ALDH1A1
SCHEMBL128091 0.77 NPC1 (0.81) NPC1RAB9AMAPTALDH1A1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101560272-B Olefinic polymerization catalyst, preparation method and polymerization method YINGKOU XIANGYANG CATALYST CO LTD 2011-04-13 — — CN disclosed
CN-101560273-B Olefinic polymerization catalyst, preparation method and polymerization method YINGKOU XIANGYANG CATALYST CO LTD 2011-03-23 — — CN disclosed
CN-101560273-A Olefinic polymerization catalyst, preparation method and polymerization method YINGKOU XIANGYANG CATALYST CO (CN) 2009-10-21 — — CN disclosed
CN-101560272-A Olefinic polymerization catalyst, preparation method and polymerization method YINGKOU XIANGYANG CATALYST CO (CN) 2009-10-21 — — CN disclosed
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