SCHEMBL19861862

SCHEMBL19861862

CCc1cccc(-c2nc3c(O)cccc3nc2-c2ccc(O)cc2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 3/20 0.50
KMT2A Q03164 2/20 0.48
MEN1 O00255 1/20 0.48
ACHE P22303 1/20 0.42
ALDH1A1 P00352 1/20 0.40
GAA P10253 1/20 0.40
MAPT P10636 1/20 0.40
RAB9A P51151 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
BCL2 P10415 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.38
NQO2 P16083 1/20 0.38
POLB P06746 1/20 0.38
FGFR2 P21802 1/20 0.37
FGFR3 P22607 1/20 0.37
MMP3 P08254 1/20 0.37
PTGS2 P35354 1/20 0.36
IDO1 P14902 1/20 0.35
PIK3CG P48736 1/20 0.35
NR1H2 P55055 1/20 0.35

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
SCHEMBL8407376 0.82 KMT2A (0.71) KMT2AMEN1ACHEALDH1A1GAA
SCHEMBL28037618 0.82 KMT2A (0.71) KMT2AMEN1ACHEALDH1A1GAA
SCHEMBL8407328 0.80 KMT2A (0.51) KMT2AMEN1ACHEALDH1A1GAA
SCHEMBL30575027 0.75 ACHE (0.63) KMT2AMEN1ACHEALDH1A1GAA
SCHEMBL8371593 0.75 ACHE (0.63) KMT2AMEN1ACHEALDH1A1GAA
SCHEMBL1513615 0.74 FGFR1 (0.64) FGFR1KMT2AMEN1BCL2FGFR2
SCHEMBL8407551 0.74 TDP1 (0.67) KMT2AMEN1ACHEALDH1A1GAA
SCHEMBL8407455 0.73 TDP1 (0.49) KMT2AMEN1ACHEALDH1A1GAA
SCHEMBL14144081 0.71 ACHE (0.57) KMT2AMEN1ACHEALDH1A1GAA
SCHEMBL10547575 0.71 MEN1 (0.61) KMT2AMEN1ACHEALDH1A1GAA

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
US-9889131-B2 Cadherin-11 inhibitors and methods of use thereof GEORGETOWN UNIVERSITY (US) 2018-02-13 US disclosed