SCHEMBL25867842

SCHEMBL25867842

C=CCCCCOc1ccc(/N=N/c2ccc(OCCCCC=C)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.51
ALDH1A1 P00352 1/20 0.51
FURIN P09958 1/20 0.42
PPARA Q07869 2/20 0.41
CHRNA7 P36544 1/20 0.41
CHRNA10 Q9GZZ6 1/20 0.41
CHRNA9 Q9UGM1 1/20 0.41
CYP2C9 P11712 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP19A1 P11511 1/20 0.39
CYP2C19 P33261 1/20 0.39
KCNA3 P22001 1/20 0.39
HTT P42858 1/20 0.39
ALDH2 P05091 1/20 0.37
MAOA P21397 1/20 0.37
MAOB P27338 1/20 0.37
NPC1 O15118 1/20 0.36
TP53 P04637 1/20 0.36
RAB9A P51151 1/20 0.36
PPARG P37231 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
SCHEMBL2789175 0.92 PPARA (0.49) L3MBTL1ALDH1A1PPARACHRNA7CHRNA10
SCHEMBL2789178 0.92 PPARA (0.49) L3MBTL1ALDH1A1PPARACHRNA7CHRNA10
SCHEMBL8553182 0.88 L3MBTL1 (0.61) L3MBTL1ALDH1A1KCNA3HTTALDH2
SCHEMBL23269681 0.88 ALDH1A1 (0.55) L3MBTL1ALDH1A1FURINPPARACHRNA7
SCHEMBL15365357 0.86 ALDH1A1 (0.59) L3MBTL1ALDH1A1KCNA3HTTALDH2
SCHEMBL28831993 0.85 PPARA (0.44) L3MBTL1ALDH1A1PPARACYP2C9CYP1A2
SCHEMBL9699119 0.82 ALDH1A1 (0.56) L3MBTL1ALDH1A1CYP2C9CYP1A2CYP19A1
SCHEMBL13653962 0.82 ALDH1A1 (0.45) L3MBTL1ALDH1A1FURINCYP2C9CYP1A2
SCHEMBL14078010 0.81 ALDH1A1 (0.54) L3MBTL1ALDH1A1KCNA3HTTHDAC1
SCHEMBL14078006 0.81 ALDH1A1 (0.54) L3MBTL1ALDH1A1KCNA3HTTALDH2

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-20240247086-A1 Electromechanical Soft Actuator Driven by Low Voltage THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2024-07-25 US claimed
US-20240247086-A1 Electromechanical Soft Actuator Driven by Low Voltage THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2024-07-25 US disclosed
US-11708458-B2 Composition for thiol-ene-based polymerization and liquid crystalline network-containing objects formed therefrom using additive manufacturing UT-BATTELLE, LLC (US) 2023-07-25 US disclosed
US-11708458-B2 Composition for thiol-ene-based polymerization and liquid crystalline network-containing objects formed therefrom using additive manufacturing UT-BATTELLE, LLC (US) 2023-07-25 US disclosed