SCHEMBL9833333

SCHEMBL9833333

CCOC(=O)C1CN(C2CCCCC2)CC1=O

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 14/20 0.49
MEN1 O00255 4/20 0.49
KMT2A Q03164 4/20 0.49
TSHR P16473 2/20 0.43
MAPT P10636 2/20 0.43
TLR4 O00206 1/20 0.41
MAPK1 P28482 2/20 0.40
POLB P06746 2/20 0.39
KDM4E B2RXH2 1/20 0.38
GAA P10253 1/20 0.38
HPGD P15428 1/20 0.38
HSD17B10 Q99714 1/20 0.38
SMN1; SMN2 Q16637 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
SCHEMBL9831077 0.99 ALDH1A1 (0.47) ALDH1A1MEN1KMT2ATSHRMAPT
SCHEMBL9832302 0.93 MAPT (0.46) ALDH1A1MEN1KMT2AMAPTTLR4
SCHEMBL19360216 0.81 ALDH1A1 (0.42) ALDH1A1MEN1KMT2ATSHRMAPT
SCHEMBL864567 0.81 ALDH1A1 (0.45) ALDH1A1MEN1KMT2ATSHRMAPT
SCHEMBL2048119 0.79 ALDH1A1 (0.43) ALDH1A1MEN1KMT2ATSHRMAPT
SCHEMBL11568317 0.78 MAPT (0.43) ALDH1A1MEN1KMT2AMAPTTLR4
SCHEMBL9829971 0.78 MAPT (0.41) ALDH1A1MEN1KMT2AMAPTTLR4
SCHEMBL858179 0.75 BRD4 (0.38)
SCHEMBL9830385 0.75 MAPT (0.49) ALDH1A1MEN1KMT2ATSHRMAPT
SCHEMBL9734800 0.74 MAPT (0.56) ALDH1A1MEN1KMT2ATSHRMAPT

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 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
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