SCHEMBL9348606

SCHEMBL9348606

COc1cc(NC(OC)OC)cc(OC)c1OC

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.56
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
MAPK1 P28482 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
G6PD P11413 1/20 0.47
ACHE P22303 1/20 0.46
CYP3A4 P08684 1/20 0.45
CA9 Q16790 1/20 0.45
PTGS2 P35354 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.40
POLB P06746 1/20 0.39
RAD52 P43351 1/20 0.39
APOBEC3A P31941 1/20 0.39
APOBEC3G Q9HC16 1/20 0.39
TUBB4A P04350 1/20 0.39
TUBB P07437 1/20 0.39
TUBA3C P0DPH7 1/20 0.39
TUBA1B P68363 1/20 0.39
TUBA4A P68366 1/20 0.39

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
SCHEMBL25896876 0.82 MAPT (0.54) MAPTMEN1KMT2AMAPK1SMN1; SMN2
SCHEMBL5300778 0.81 MAPT (0.58) MAPTMEN1KMT2AMAPK1SMN1; SMN2
SCHEMBL9525229 0.78 MAPT (0.54) MAPTMEN1KMT2AMAPK1SMN1; SMN2
SCHEMBL12932855 0.75 MAPK1 (0.51) MAPTMEN1KMT2AMAPK1SMN1; SMN2
SCHEMBL12963097 0.75 G6PD (0.59) MAPTMEN1KMT2AMAPK1SMN1; SMN2
SCHEMBL2097204 0.73 ACHE (0.54) MAPTMEN1KMT2AMAPK1SMN1; SMN2
SCHEMBL2674642 0.72 MEN1 (0.53) MAPTMEN1KMT2AMAPK1SMN1; SMN2
SCHEMBL4099563 0.72 MAPT (0.49) MAPTMEN1KMT2AMAPK1SMN1; SMN2
SCHEMBL29254055 0.72 MEN1 (1.00) MAPTMEN1KMT2AMAPK1SMN1; SMN2
SCHEMBL1651683 0.71 ACHE (0.52) MAPTMEN1KMT2AMAPK1SMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5296602-A Condensing substituted ortho-halo- or ortho-aminobenzoic acid with meta-halo- or meta-aminoanisole, cyclizing, N-alkylating, de-O-methylating SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 1994-03-22 US disclosed
WO-1992016509-A1 MULTISUBSTITUTED 1-HYDROXY-9-ACRIDONES WITH ANTICANCER ACTIVITY SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 1992-10-01 WO disclosed