SCHEMBL31516134

SCHEMBL31516134

CCCCCCCCCCc1csc(B2OC(C)(C)C(C)(C)O2)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LPL P06858 6/20 0.56
▸ LIPG Q9Y5X9 6/20 0.56
▸ PTGS2 P35354 4/20 0.37
▸ OPRM1 P35372 3/20 0.34
▸ CYP3A4 P08684 2/20 0.34
▸ ESR1 P03372 2/20 0.33
▸ ADRA2A P08913 2/20 0.33
▸ ADORA3 P0DMS8 2/20 0.33
▸ TACR2 P21452 2/20 0.33
▸ SLC6A2 P23975 2/20 0.33
▸ SLC6A4 P31645 2/20 0.33
▸ SLC6A3 Q01959 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ SHBG P04278 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ HSPD1 P10809 1/20 0.33
▸ ADRB3 P13945 1/20 0.33
▸ HTR2C P28335 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
SCHEMBL121471 1.00 LPL (0.56) LPLLIPGPTGS2OPRM1CYP3A4
SCHEMBL15072065 1.00 LPL (0.56) LPLLIPGPTGS2OPRM1CYP3A4
SCHEMBL9891143 0.98 LPL (0.55) LPLLIPGPTGS2OPRM1CYP3A4
SCHEMBL12913268 0.94 LPL (0.49) LPLLIPGOPRM1
SCHEMBL27949745 0.86 LPL (0.45) LPLLIPGPTGS2OPRM1
SCHEMBL19176431 0.82 LPL (0.41) LPLLIPG
SCHEMBL18966974 0.82 LPL (0.41) LPLLIPG
SCHEMBL12122384 0.82 LPL (0.50) LPLLIPGPTGS2OPRM1CYP3A4
SCHEMBL868509 0.82 LPL (0.40) LPLLIPGPTGS2OPRM1CYP3A4
SCHEMBL14941616 0.82 LPL (0.40) LPLLIPGPTGS2OPRM1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250160193-A1 CONJUGATED POLYMERS AS HOLE TRANSPORT MATERIALS FOR ENHANCED THERMAL STABILITY IN OPTOELECTRONIC DEVICES U. S. DEPARTMENT OF ENERGY 2025-05-15 — — US disclosed
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