SCHEMBL8081664

SCHEMBL8081664

CCCC(C)Oc1ccc(OC(C)=O)cc1OC(C)CCC

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.45
ELANE P08246 1/20 0.42
MAPT P10636 1/20 0.41
MAPK1 P28482 1/20 0.41
LMNA P02545 3/20 0.39
NPC1 O15118 1/20 0.39
PKM P14618 1/20 0.39
HTT P42858 1/20 0.39
RAB9A P51151 1/20 0.39
CYP3A4 P08684 1/20 0.38
ALOX5 P09917 2/20 0.38
ACHE P22303 1/20 0.38
PPARG P37231 6/20 0.38
PPARA Q07869 6/20 0.38
PPARD Q03181 4/20 0.38
KMT2A Q03164 1/20 0.36
POLB P06746 1/20 0.36

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
SCHEMBL8080297 0.92 KDM4E (0.43) KDM4EELANEMAPTMAPK1LMNA
SCHEMBL8072267 0.90 ALOX5 (0.44) KDM4EELANEMAPTMAPK1LMNA
SCHEMBL8072665 0.88 KDM4E (0.47) KDM4EELANEMAPTMAPK1LMNA
SCHEMBL8086442 0.84 ALOX5 (0.45) KDM4EELANEMAPTMAPK1LMNA
SCHEMBL8081109 0.83 LMNA (0.48) KDM4EELANEMAPTLMNAPKM
SCHEMBL8081848 0.76 TSHR (0.49) KDM4EMAPK1LMNAHTTRAB9A
SCHEMBL8080246 0.75 ALOX5 (0.49) KDM4EELANEMAPTMAPK1LMNA
SCHEMBL10440807 0.75 LMNA (0.53) MAPTLMNACYP3A4POLB
SCHEMBL9253921 0.75 LMNA (0.53) MAPTLMNACYP3A4POLB
SCHEMBL8081333 0.74 ALOX5 (0.51) KDM4EMAPTMAPK1LMNAHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0758013-B1 Liquid crystalline optical film, compensating film for liquid crystal display and liquid crystal display NIPPON OIL CO LTD (JP) 2000-10-11 EP disclosed
US-5855971-A Liquid crystalline optical film, compensating film for liquid crystal display comprising the liquid crystalline optical film, and liquid crystal display having the compensating film NIPPON OIL COMPANY, LIMITED (JP) 1999-01-05 US disclosed
EP-0758013-A1 Liquid crystalline optical film, compensating film for liquid crystal display and liquid crystal display NIPPON OIL COMPANY, LIMITED (JP) 1997-02-12 EP disclosed