SCHEMBL16685634

SCHEMBL16685634

CCCCOc1c(C)cc(OBOc2cc(C)c(OCCCC)c(C)c2)cc1C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ THRA P10827 3/20 0.40
▸ THRB P10828 3/20 0.40
▸ KDM4E B2RXH2 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ S1PR2 O95136 1/20 0.36
▸ S1PR1 P21453 1/20 0.36
▸ S1PR3 Q99500 1/20 0.36
▸ LPAR2 Q9HBW0 1/20 0.36
▸ LTA4H P09960 2/20 0.35
▸ NR5A1 Q13285 1/20 0.34
▸ CYP19A1 P11511 4/20 0.34
▸ CYP2C9 P11712 4/20 0.34
▸ CYP2C19 P33261 4/20 0.34
▸ CYP2D6 P10635 2/20 0.34
▸ CYP1A2 P05177 2/20 0.34
▸ CYP3A4 P08684 1/20 0.34
▸ HTR1A P08908 1/20 0.33

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
SCHEMBL11586422 0.78 KMT2A (0.46) THRATHRBKDM4EALDH1A1LMNA
SCHEMBL14154503 0.75 S1PR2 (0.44) THRATHRBKDM4EALDH1A1LMNA
SCHEMBL1018667 0.74 LTA4H (0.55) LTA4HNR5A1CYP19A1CYP2C9CYP2C19
SCHEMBL12749079 0.73 THRA (0.42) THRATHRBKDM4EALDH1A1LMNA
SCHEMBL15187966 0.73 THRA (0.42) THRATHRBKDM4EALDH1A1LMNA
SCHEMBL9946026 0.72 THRA (0.41) THRATHRBKDM4EALDH1A1LMNA
SCHEMBL4814773 0.71 ESR1 (0.42) KDM4EALDH1A1MAPTLTA4H
SCHEMBL11448 0.71 ALDH1A1 (0.36) ALDH1A1MAPTCYP3A4
SCHEMBL19594430 0.71 THRA (0.54) THRATHRBKDM4EALDH1A1S1PR2
SCHEMBL11956145 0.71 THRA (0.54) THRATHRBKDM4EALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10351886-B2 Methods for high yield production of furans from biomass sugars at mild operating conditions THE UNIVERSITY OF TOLEDO (US) 2019-07-16 — — US claimed
US-20180127793-A1 Methods for High Yield Production of Furans from Biomass Sugars at Mild Operating Conditions THE UNIVERSITY OF TOLEDO (US) 2018-05-10 — — US claimed
US-9828615-B2 Methods for high yield production of furans from biomass sugars at mild operating conditions THE UNIVERSITY OF TOLEDO (US) 2017-11-28 — — US claimed
US-20160281120-A1 Methods for High Yield Production of Furans from Biomass Sugars at Mild Operating Conditions THE UNIVERSITY OF TOLEDO (US) 2016-09-29 — — US claimed
WO-2015066287-A1 METHODS FOR HIGH YIELD PRODUCTION OF FURANS FROM BIOMASS SUGARS AT MILD OPERATING CONDITIONS THE UNIVERSITY OF TOLEDO (US) 2015-05-07 — — WO claimed
US-10351886-B2 Methods for high yield production of furans from biomass sugars at mild operating conditions THE UNIVERSITY OF TOLEDO (US) 2019-07-16 — — US disclosed
US-20180127793-A1 Methods for High Yield Production of Furans from Biomass Sugars at Mild Operating Conditions THE UNIVERSITY OF TOLEDO (US) 2018-05-10 — — US disclosed
US-9828615-B2 Methods for high yield production of furans from biomass sugars at mild operating conditions THE UNIVERSITY OF TOLEDO (US) 2017-11-28 — — US disclosed
US-20160281120-A1 Methods for High Yield Production of Furans from Biomass Sugars at Mild Operating Conditions THE UNIVERSITY OF TOLEDO (US) 2016-09-29 — — US disclosed
WO-2015066287-A1 METHODS FOR HIGH YIELD PRODUCTION OF FURANS FROM BIOMASS SUGARS AT MILD OPERATING CONDITIONS THE UNIVERSITY OF TOLEDO (US) 2015-05-07 — — WO disclosed
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