SCHEMBL6367754

SCHEMBL6367754

CCCCCCCCCCCCC1CCC(C2CCC(c3ccc(Cc4ccc(N)cc4)cc3N)CC2)CC1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.34
GAA P10253 1/20 0.34
CYP3A4 P08684 2/20 0.34
CYP2C8 P10632 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
S1PR3 Q99500 1/20 0.34
SPHK1 Q9NYA1 4/20 0.34
GRM2 Q14416 2/20 0.33
ALDH1A1 P00352 1/20 0.32
TSHR P16473 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
TRPV1 Q8NER1 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
DRD2 P14416 1/20 0.30
SLC6A2 P23975 1/20 0.30
HTR2A P28223 1/20 0.30
HTR2C P28335 1/20 0.30

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
SCHEMBL6752073 1.00 MAPT (0.34) MAPTGAACYP3A4CYP2C8CYP2D6
SCHEMBL6362663 1.00 MAPT (0.34) MAPTGAACYP3A4CYP2C8CYP2D6
SCHEMBL7733088 1.00 MAPT (0.34) MAPTGAACYP3A4CYP2C8CYP2D6
SCHEMBL6367773 0.99 CYP3A4 (0.33) MAPTGAACYP3A4CYP2C8CYP2D6
SCHEMBL6363296 0.91 GRM2 (0.36) MAPTGAACYP3A4CYP2C8CYP2D6
SCHEMBL6362621 0.91 GRM2 (0.36) MAPTGAACYP3A4CYP2C8CYP2D6
SCHEMBL6362211 0.91 GRM2 (0.36) MAPTGAACYP3A4CYP2C8CYP2D6
SCHEMBL7732440 0.91 CYP2C9 (0.36) MAPTGAACYP3A4CYP2C9ALDH1A1
SCHEMBL6363303 0.91 CYP2C9 (0.36) MAPTGAACYP3A4CYP2C9ALDH1A1
SCHEMBL6363955 0.90 GRM2 (0.34) MAPTGAACYP3A4CYP2C8CYP2D6

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