SCHEMBL9831077

SCHEMBL9831077

CCOC(=O)C1CN(C2CCCC2)CC1=O

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 12/20 0.47
KMT2A Q03164 5/20 0.47
MEN1 O00255 4/20 0.47
MAPT P10636 2/20 0.43
TLR4 O00206 1/20 0.42
TSHR P16473 1/20 0.41
POLB P06746 3/20 0.39
KDM4E B2RXH2 1/20 0.39
GAA P10253 1/20 0.39
HPGD P15428 1/20 0.39
HSD17B10 Q99714 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MAPK1 P28482 1/20 0.38

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
SCHEMBL9833333 0.99 ALDH1A1 (0.49) ALDH1A1KMT2AMEN1MAPTTLR4
SCHEMBL9832302 0.94 MAPT (0.46) ALDH1A1KMT2AMEN1MAPTTLR4
SCHEMBL19360216 0.82 ALDH1A1 (0.42) ALDH1A1KMT2AMEN1MAPTTLR4
SCHEMBL864567 0.82 ALDH1A1 (0.45) ALDH1A1KMT2AMEN1MAPTTLR4
SCHEMBL2048119 0.80 ALDH1A1 (0.43) ALDH1A1KMT2AMEN1MAPTTLR4
SCHEMBL11568317 0.79 MAPT (0.43) ALDH1A1KMT2AMEN1MAPTTLR4
SCHEMBL9830385 0.76 MAPT (0.49) ALDH1A1KMT2AMEN1MAPTTLR4
SCHEMBL858179 0.76 BRD4 (0.38)
SCHEMBL9829971 0.76 MAPT (0.41) ALDH1A1KMT2AMEN1MAPTTLR4
SCHEMBL9831234 0.75 CHRM2 (0.48) ALDH1A1KMT2AMEN1MAPTTLR4

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 5 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 claimed
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 claimed
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