SCHEMBL9634709

SCHEMBL9634709

C=Cc1ccc(CN(Cc2ccccc2)Cc2ccccc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.52
TSHR P16473 2/20 0.52
CNR2 P34972 1/20 0.48
G6PC1 P35575 4/20 0.41
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
GAA P10253 1/20 0.40
AOC3 Q16853 1/20 0.39
POLB P06746 1/20 0.39
PTPN1 P18031 2/20 0.38
HTT P42858 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL18493252 1.00 ALDH1A1 (0.52) ALDH1A1TSHRCNR2G6PC1CA1
SCHEMBL13051057 0.94 ALDH1A1 (0.46) ALDH1A1TSHRCNR2G6PC1CA1
SCHEMBL18493213 0.91 ALDH1A1 (0.55) ALDH1A1TSHRCNR2CA1CA2
SCHEMBL3356598 0.87 OPRK1 (0.49) ALDH1A1TSHRCA1CA2HTT
SCHEMBL3356121 0.87 OPRK1 (0.53) ALDH1A1TSHRL3MBTL1
SCHEMBL13051059 0.84 HRH3 (0.56) TSHRCNR2L3MBTL1
SCHEMBL17409806 0.84 BCHE (0.49) ALDH1A1TSHRAOC3
SCHEMBL6390256 0.83 ALDH1A1 (0.50) ALDH1A1TSHRGAAPOLBHTT
SCHEMBL3356627 0.82 BCHE (0.50) CNR2CA1CA2AOC3
SCHEMBL12049793 0.82 CNR2 (0.64) ALDH1A1TSHRCNR2CA2AOC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118388726-A Solution polymerized styrene butadiene rubber containing N/O/Si functional monomer and preparation method thereof 湖南理工学院 2024-07-26 CN claimed
CN-117229460-A Amino-functionalized transparent impact-resistant styrene-piperylene copolymer resin and preparation method thereof 湖南理工学院 2023-12-15 CN claimed
CN-116693782-A Thermoplastic elastomer containing O/N/Si functional monomer and preparation method thereof 湖南理工学院 2023-09-05 CN claimed
CN-118388726-A Solution polymerized styrene butadiene rubber containing N/O/Si functional monomer and preparation method thereof 湖南理工学院 2024-07-26 CN disclosed
CN-117229460-A Amino-functionalized transparent impact-resistant styrene-piperylene copolymer resin and preparation method thereof 湖南理工学院 2023-12-15 CN disclosed
CN-116693782-A Thermoplastic elastomer containing O/N/Si functional monomer and preparation method thereof 湖南理工学院 2023-09-05 CN disclosed
US-5147750-A Amino group containing polymers; narrow electrostatic charge distribution SANYO CHEMICAL INDUSTRIES, LTD. (JP) 1992-09-15 US disclosed