SCHEMBL13410397

SCHEMBL13410397

CCCCCCCCCCCCCCCCc1ccc(B2OC(C)(C)C(C)(C)O2)s1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LPL P06858 6/20 0.55
▸ LIPG Q9Y5X9 6/20 0.55
▸ POLB P06746 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ ESR1 P03372 2/20 0.32
▸ ADRA2A P08913 2/20 0.32
▸ ADORA3 P0DMS8 2/20 0.32
▸ TACR2 P21452 2/20 0.32
▸ SLC6A2 P23975 2/20 0.32
▸ SLC6A4 P31645 2/20 0.32
▸ SLC6A3 Q01959 2/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ SHBG P04278 1/20 0.32
▸ TP53 P04637 1/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ HSPD1 P10809 1/20 0.32
▸ ADRB3 P13945 1/20 0.32
▸ HTR2C P28335 1/20 0.32

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
SCHEMBL13410351 1.00 LPL (0.55) LPLLIPGPOLBTDP1ESR1
SCHEMBL12276242 1.00 LPL (0.55) LPLLIPGPOLBTDP1ESR1
SCHEMBL12122383 1.00 LPL (0.55) LPLLIPGPOLBTDP1ESR1
SCHEMBL1568941 0.98 LPL (0.54) LPLLIPGPOLBTDP1ALDH1A1
SCHEMBL13976523 0.94 LPL (0.47) LPLLIPGPOLBALDH1A1HSD17B10
SCHEMBL119235 0.91 LPL (0.50) LPLLIPGPOLBTDP1KDM4E
SCHEMBL2768064 0.90 LPL (0.49) LPLLIPGKDM4E
SCHEMBL2768124 0.90 LPL (0.49) LPLLIPGKDM4E
SCHEMBL12338985 0.88 LPL (0.47) LPLLIPGPOLBALDH1A1
SCHEMBL16600323 0.87 LPL (0.50) LPLLIPG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8441002-B2 Organic semiconductor composite, organic transistor material and organic field effect transistor TORAY INDUSTRIES, INC. (JP) 2013-05-14 — — US disclosed
US-20100102299-A1 ORGANIC SEMICONDUCTOR COMPOSITE, ORGANIC TRANSISTOR MATERIAL AND ORGANIC FIELD EFFECT TRANSISTOR TORAY INDUSTRIES, INC. (JP) 2010-04-29 — — US disclosed
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