SCHEMBL9829293

SCHEMBL9829293

CCOC(=O)CCNc1c(Cl)cc(Cl)cc1Cl

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 1/20 0.51
TOP2A P11388 3/20 0.51
MAPT P10636 2/20 0.41
KDM4E B2RXH2 1/20 0.41
TP53 P04637 1/20 0.41
NLRP3 Q96P20 1/20 0.41
KAT2B Q92831 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
PLAU P00749 2/20 0.40
MEN1 O00255 1/20 0.40
HPGD P15428 1/20 0.40
KMT2A Q03164 1/20 0.40
BCL6 P41182 1/20 0.39
BCOR Q6W2J9 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
MGAM O43451 1/20 0.38
GAA P10253 1/20 0.38
SI P14410 1/20 0.38
MGAM2 Q2M2H8 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
SCHEMBL8880107 0.83 L3MBTL1 (0.46) ABCB1TOP2AMAPTKDM4EKAT2B
SCHEMBL9832125 0.82 ABCB1 (0.47) ABCB1TOP2AMAPTKDM4ETP53
SCHEMBL9833523 0.81 MAPT (0.51) TOP2AMAPTKDM4ETDP1MEN1
SCHEMBL9830102 0.78 TOP2A (0.45) TOP2AMAPTNLRP3KAT2BPLAU
SCHEMBL9832539 0.78 BCL6 (0.46) TOP2AMAPTKDM4ENLRP3KAT2B
SCHEMBL9831365 0.78 MEN1 (0.52) TOP2AMAPTKDM4ETDP1MEN1
SCHEMBL9829734 0.78 NLRP3 (0.56) TOP2ANLRP3HPGDMGAMGAA
SCHEMBL27943015 0.77 MAPT (0.58) MAPTKDM4EMEN1KMT2A
SCHEMBL7106986 0.76 CYP4F2 (0.50) TOP2AMAPTKDM4EHPGD
SCHEMBL658049 0.76 MAPT (0.59) TOP2AMAPTKDM4ETDP1MEN1

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