SCHEMBL181524

SCHEMBL181524

CCCCCCCCc1ccc2cc(C=O)ccc2c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLA2G4A P47712 1/20 0.51
KAT8 Q9H7Z6 2/20 0.44
THRB P10828 2/20 0.44
PPARA Q07869 1/20 0.44
S1PR1 P21453 1/20 0.43
S1PR3 Q99500 1/20 0.43
ESR1 P03372 2/20 0.43
ADRA2A P08913 2/20 0.43
ADORA3 P0DMS8 2/20 0.43
TACR2 P21452 2/20 0.43
SLC6A2 P23975 2/20 0.43
SLC6A4 P31645 2/20 0.43
SLC6A3 Q01959 2/20 0.43
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
SHBG P04278 1/20 0.43
TP53 P04637 1/20 0.43
CYP3A4 P08684 1/20 0.43
HSPD1 P10809 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
SCHEMBL11690859 0.84 PTGS2 (0.57) KAT8PPARAESR1ADRA2AADORA3
SCHEMBL27844768 0.84 PTGS2 (0.57) KAT8PPARAESR1ADRA2AADORA3
SCHEMBL27995689 0.84 PTGS2 (0.57) KAT8PPARAESR1ADRA2AADORA3
SCHEMBL11222681 0.84 PTGS2 (0.57) KAT8PPARAESR1ADRA2AADORA3
SCHEMBL29266159 0.84 ESR1 (0.43) KAT8THRBPPARAESR1ADRA2A
SCHEMBL29266162 0.84 ESR1 (0.43) KAT8THRBPPARAESR1ADRA2A
SCHEMBL16920607 0.84 ALDH1A1 (0.42) PLA2G4ATHRBS1PR1S1PR3ALDH1A1
SCHEMBL177373 0.83 ESR1 (0.57) THRBESR1ADRA2AADORA3TACR2
SCHEMBL9026740 0.83 ESR1 (0.57) THRBESR1ADRA2AADORA3TACR2
SCHEMBL20594193 0.83 ESR1 (0.57) THRBESR1ADRA2AADORA3TACR2

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
US-9796727-B2 Field effect transistor NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2017-10-24 US disclosed
EP-2402348-B1 FIELD EFFECT TRANSISTOR NIPPON KAYAKU KK (JP) 2017-04-12 EP disclosed
EP-2402348-A1 FIELD EFFECT TRANSISTOR Hiroshima University (JP) 2012-01-04 EP disclosed
WO-2010098372-A1 FIELD EFFECT TRANSISTOR 国立大学法人広島大学 (JP) 2010-09-02 WO disclosed