SCHEMBL6363296

SCHEMBL6363296

CCCCCCCCCCC1CCC(C2CCC(c3ccc(Cc4cccc(N)c4)cc3N)CC2)CC1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 1/20 0.36
TSHR P16473 1/20 0.34
PLG P00747 1/20 0.34
PRSS1 P07477 1/20 0.34
PRSS2 P07478 1/20 0.34
PRSS3 P35030 1/20 0.34
CYP3A4 P08684 1/20 0.33
CYP2C8 P10632 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
S1PR3 Q99500 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
SPHK1 Q9NYA1 1/20 0.33
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
DRD2 P14416 1/20 0.31
SLC6A2 P23975 1/20 0.31

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
SCHEMBL6362621 1.00 GRM2 (0.36) GRM2TSHRPLGPRSS1PRSS2
SCHEMBL6362211 1.00 GRM2 (0.36) GRM2TSHRPLGPRSS1PRSS2
SCHEMBL6363955 0.99 GRM2 (0.34) GRM2TSHRPLGPRSS1PRSS2
SCHEMBL7733088 0.91 MAPT (0.34) GRM2TSHRCYP3A4CYP2C8CYP2D6
SCHEMBL6752073 0.91 MAPT (0.34) GRM2TSHRCYP3A4CYP2C8CYP2D6
SCHEMBL6367754 0.91 MAPT (0.34) GRM2TSHRCYP3A4CYP2C8CYP2D6
SCHEMBL6362663 0.91 MAPT (0.34) GRM2TSHRCYP3A4CYP2C8CYP2D6
SCHEMBL6367153 0.91 CYP2C9 (0.34) GRM2CYP2C9GAAMAPTCA1
SCHEMBL6367773 0.90 CYP3A4 (0.33) GRM2TSHRCYP3A4CYP2C8CYP2D6
SCHEMBL7734018 0.85 TLR8 (0.32) TSHRCYP3A4CYP2C8CYP2D6CYP2C9

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-6949281-B1 Varnish composition and liquid-crystal display element CHISSO CORPORATION (JP) 2005-09-27 US disclosed
US-6746730-B1 VARNISH COMPOSITION WHICH COMPRISES POLYMER COMPONENT CONTAINING TWO DIFFERENT POLYAMIC ACIDS, SOLUBLE POLYIMIDE, AND SOLVENT FOR DISSOLVING POLYMER COMPONENT CHISSO CORPORATION (JP) 2004-06-08 US disclosed