SCHEMBL29048683

SCHEMBL29048683

CCOc1ccc(-c2cc(-c3ccc(Nc4ccc(C(C)(C)C)cc4)cc3)ccn2)c(OCC)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR2 P21802 7/20 0.41
MAPT P10636 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37
KDM4E B2RXH2 1/20 0.36
LMNA P02545 1/20 0.36
TP53 P04637 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
SYK P43405 1/20 0.36
ALOX5 P09917 1/20 0.36
POLB P06746 1/20 0.36
GRIN2C Q14957 1/20 0.36
MAPK10 P53779 1/20 0.36
PDGFRB P09619 1/20 0.35
KIT P10721 1/20 0.35
PDGFRA P16234 1/20 0.35
KDR P35968 1/20 0.35
TGFBR1 P36897 1/20 0.35
XDH P47989 1/20 0.34
SLC22A12 Q96S37 1/20 0.34
MEN1 O00255 1/20 0.34

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
SCHEMBL29048679 0.91 SYK (0.43) MAPTKDM4ELMNATP53SMN1; SMN2
SCHEMBL29048622 0.89 KDM4E (0.36) FGFR2MAPTKDM4ELMNATP53
SCHEMBL30526018 0.89 KDM4E (0.42) FGFR2MAPTRXFP1KDM4ELMNA
SCHEMBL21670531 0.89 KDM4E (0.42) FGFR2MAPTRXFP1KDM4ELMNA
SCHEMBL29048609 0.88 KDM4E (0.45) FGFR2MAPTKDM4ELMNATP53
SCHEMBL29048664 0.88 AGPAT2 (0.39) MAPTKDM4ELMNATP53SMN1; SMN2
SCHEMBL29048632 0.88 MAPT (0.43) FGFR2MAPTKDM4ELMNATP53
SCHEMBL29048634 0.87 MAPKAPK2 (0.42) FGFR2MAPTKDM4ELMNATP53
SCHEMBL29048613 0.87 MAPK10 (0.44) FGFR2LMNAPOLBMAPK10TGFBR1
SCHEMBL29048684 0.86 MAPT (0.36) MAPTKDM4ELMNATP53SMN1; SMN2

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
CN-110446770-B Reversible thermochromic composition and reversible thermochromic microcapsule pigment containing the same 百乐墨水株式会社 2023-08-08 CN disclosed