SCHEMBL4818156

SCHEMBL4818156

c1ccc2c(c1)CCc1cc3c(cc1-2)CCc1ccccc1-3

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CES1 P23141 1/20 0.56
▸ SRD5A1 P18405 1/20 0.55
▸ SRD5A2 P31213 1/20 0.55
▸ RAB9A P51151 3/20 0.48
▸ NPC1 O15118 2/20 0.48
▸ MITF O75030 1/20 0.46
▸ HSP90AA1 P07900 1/20 0.46
▸ TDP1 Q9NUW8 1/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ CYP2A6 P11509 1/20 0.44
▸ MAOA P21397 1/20 0.44
▸ MAOB P27338 1/20 0.44
▸ SETD7 Q8WTS6 1/20 0.43
▸ DRD1 P21728 1/20 0.42
▸ DRD5 P21918 1/20 0.42
▸ KDM4E B2RXH2 2/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ LMNA P02545 2/20 0.41
▸ HPGD P15428 2/20 0.41
▸ NOS3 P29474 1/20 0.41

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
SCHEMBL5357317 0.91 RAB9A (0.55) CES1SRD5A1SRD5A2RAB9ANPC1
SCHEMBL10348692 0.89 TSHR (0.50) CES1SRD5A1SRD5A2RAB9ANPC1
Dihydrophenanthrene SCHEMBL155991 0.88 CES1 (0.68) CES1SRD5A1SRD5A2RAB9ANPC1
Dihydrophenanthrene SCHEMBL30297028 0.88 CES1 (0.68) CES1SRD5A1SRD5A2RAB9ANPC1
Dihydrophenanthrene SCHEMBL29404495 0.88 CES1 (0.68) CES1SRD5A1SRD5A2RAB9ANPC1
SCHEMBL3417362 0.85 SRD5A1 (0.48) CES1SRD5A1SRD5A2RAB9ANPC1
Dihydrophenanthrene SCHEMBL28876918 0.85 CES1 (0.65) CES1SRD5A1SRD5A2RAB9ANPC1
SCHEMBL30436624 0.85 CES1 (0.65) CES1SRD5A1SRD5A2RAB9ANPC1
Dihydrophenanthrene SCHEMBL27973960 0.85 CES1 (0.65) CES1SRD5A1SRD5A2RAB9ANPC1
Dihydrophenanthrene SCHEMBL28858771 0.85 CES1 (0.65) CES1SRD5A1SRD5A2RAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080026135-A1 ELECTRON TRANSPORT AGENTS FOR ORGANIC ELECTRONIC DEVICES 3M INNOVATIVE PROPERTIES COMPANY 2008-01-31 — — US claimed
US-7271406-B2 Electron transport agents for organic electronic devices 3M INNOVATIVE PROPERTIES COMPANY (US) 2007-09-18 — — US claimed
US-7442760-B2 Electroactive polymers 3M INNOVATIVE PROPERTIES COMPANY (US) 2008-10-28 — — US disclosed
US-7442760-B2 Electroactive polymers 3M INNOVATIVE PROPERTIES COMPANY (US) 2008-10-28 — — US disclosed
US-20080026135-A1 ELECTRON TRANSPORT AGENTS FOR ORGANIC ELECTRONIC DEVICES 3M INNOVATIVE PROPERTIES COMPANY 2008-01-31 — — US disclosed
US-20080026135-A1 ELECTRON TRANSPORT AGENTS FOR ORGANIC ELECTRONIC DEVICES 3M INNOVATIVE PROPERTIES COMPANY 2008-01-31 — — US disclosed
US-7271406-B2 Electron transport agents for organic electronic devices 3M INNOVATIVE PROPERTIES COMPANY (US) 2007-09-18 — — US disclosed
US-7271406-B2 Electron transport agents for organic electronic devices 3M INNOVATIVE PROPERTIES COMPANY (US) 2007-09-18 — — US disclosed
US-7094902-B2 Electroactive polymers 3M INNOVATIVE PROPERTIES COMPANY (US) 2006-08-22 — — US disclosed
US-20060155106-A1 ELECTROACTIVE POLYMERS 3M INNOVATIVE PROPERTIES COMPANY 2006-07-13 — — US disclosed
EP-1618169-A1 ELECTRON TRANSPORT AGENTS FOR ORGANIC ELECTRONIC DEVICES 3M Innovative Properties Company (US) 2006-01-25 — — EP disclosed
EP-1573789-A2 ELECTROACTIVE POLYMERS 3M Innovative Properties Company (US) 2005-09-14 — — EP disclosed
WO-2004102615-A2 ELECTROACTIVE POLYMERS 3M INNOVATIVE PROPERTIES COMPANY (US) 2004-11-25 — — WO disclosed
WO-2004096948-A1 ELECTRON TRANSPORT AGENTS FOR ORGANIC ELECTRONIC DEVICES 3M INNOVATIVE PROPERTIES COMPANY (US) 2004-11-11 — — WO disclosed
US-20040214036-A1 Electron transport agents for organic electronic devices 3M INNOVATIVE PROPERTIES COMPANY 2004-10-28 — — US disclosed
US-20040062930-A1 Electroactive polymers 3M INNOVATIVE PROPERTIES COMPANY 2004-04-01 — — US disclosed
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