SCHEMBL9830144

SCHEMBL9830144

CCOC(=O)CCN(CC(=O)O)c1cc(OC)cc(OC)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 1/20 0.46
BLM P54132 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.44
PPARG P37231 1/20 0.43
ALDH1A1 P00352 3/20 0.37
HPGD P15428 2/20 0.37
NPC1 O15118 1/20 0.37
GAA P10253 1/20 0.37
RAB9A P51151 1/20 0.37
LTA4H P09960 2/20 0.37
TSHR P16473 1/20 0.37
CYP3A4 P08684 1/20 0.37
ALOX15 P16050 1/20 0.36
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
POLB P06746 1/20 0.36
FGFR1 P11362 1/20 0.36
FGFR2 P21802 1/20 0.36
FGFR4 P22455 1/20 0.36

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
SCHEMBL9831770 0.92 PPARG (0.50) PLA2G2ABLMSMN1; SMN2PPARGALDH1A1
SCHEMBL10688503 0.90 SMN1; SMN2 (0.49) SMN1; SMN2PPARGALDH1A1HPGDNPC1
SCHEMBL9832657 0.87 SMN1; SMN2 (0.47) SMN1; SMN2PPARGALOX15KDM4EMAPT
SCHEMBL9829986 0.87 ALDH1A1 (0.52) SMN1; SMN2PPARGALDH1A1HPGDGAA
SCHEMBL9831883 0.85 SMN1; SMN2 (0.44) PLA2G2ABLMSMN1; SMN2PPARGGAA
SCHEMBL9829491 0.83 ALDH1A1 (0.43) SMN1; SMN2PPARGALDH1A1KDM4EMEN1
SCHEMBL10407589 0.82 SMN1; SMN2 (0.43) PLA2G2ABLMSMN1; SMN2PPARGALDH1A1
SCHEMBL9829939 0.82 SMN1; SMN2 (0.43) PLA2G2ABLMSMN1; SMN2PPARGALDH1A1
SCHEMBL10407235 0.82 SMN1; SMN2 (0.43) PLA2G2ABLMSMN1; SMN2PPARGHPGD
SCHEMBL9829977 0.81 SMN1; SMN2 (0.42) PLA2G2ABLMSMN1; SMN2PPARGHPGD

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0449989-A1 6,7 DIHYDROPYRROLO 3,4-c] PYRIDO 2,3-d] PYRIMIDINE DERIVATIVES Sloan-Kettering Institute For Cancer Research (US) 1991-10-09 EP disclosed
WO-1990007496-A1 6,7 DIHYDROPYRROLO[3,4-c] PYRIDO[2,3-d] PYRIMIDINE DERIVATIVES SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 1990-07-12 WO disclosed
US-4925939-A 6,7-dihydropyrrol[3,4-c]pyrido[2,3-d]pyrimidine derivatives SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 1990-05-15 US disclosed