SCHEMBL9829162

SCHEMBL9829162

CCOC(=O)CCNc1c(F)cc(F)cc1F

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TOP2A P11388 3/20 0.51
NLRP3 Q96P20 2/20 0.41
NPC1 O15118 1/20 0.41
LMNA P02545 3/20 0.40
CYP1A2 P05177 3/20 0.40
MAPT P10636 3/20 0.39
CYP2C19 P33261 2/20 0.39
MEN1 O00255 1/20 0.39
CYP2C9 P11712 1/20 0.39
KMT2A Q03164 1/20 0.39
NPSR1 Q6W5P4 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
POLB P06746 1/20 0.38
RAB9A P51151 1/20 0.38
CYP4F2 P78329 1/20 0.37
CYP4A11 Q02928 1/20 0.37
KDM4E B2RXH2 1/20 0.37

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
SCHEMBL9830975 0.84 TOP2A (0.47) TOP2ANPC1LMNACYP1A2MAPT
SCHEMBL9831480 0.82 POLB (0.40) TOP2ANLRP3NPC1LMNACYP1A2
SCHEMBL9830613 0.81 MEN1 (0.47) TOP2ANPC1LMNAMAPTMEN1
SCHEMBL9830974 0.79 TOP2A (0.46) TOP2ANLRP3NPC1LMNACYP1A2
SCHEMBL9830840 0.78 TOP2A (0.45) TOP2ANLRP3NPC1LMNACYP1A2
SCHEMBL9831301 0.78 TSHR (0.46) TOP2ANPC1LMNACYP1A2MAPT
SCHEMBL9829734 0.78 NLRP3 (0.56) TOP2ANLRP3LMNAMGAMGAA
SCHEMBL9830217 0.78 MAPT (0.55) TOP2ALMNACYP1A2MAPTCYP2C19
SCHEMBL9831448 0.77 HPGD (0.51) TOP2AMAPTMEN1KMT2APOLB
SCHEMBL6891724 0.76 TOP2A (0.46) TOP2ANLRP3NPC1LMNACYP1A2

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