SCHEMBL9830348

SCHEMBL9830348

CCOC(=O)CCN(CC(=O)O)c1c(Cl)cc(Cl)cc1Cl

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.39
ABCB1 P08183 1/20 0.37
KAT2B Q92831 1/20 0.36
HPGD P15428 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
KDM4E B2RXH2 3/20 0.34
LTA4H P09960 2/20 0.34
TDP1 Q9NUW8 2/20 0.34
ALOX5 P09917 1/20 0.34
TSHR P16473 2/20 0.34
NPC1 O15118 1/20 0.34
LMNA P02545 1/20 0.34
POLB P06746 1/20 0.34
RAB9A P51151 1/20 0.34
ALDH1A1 P00352 1/20 0.33
GLA P06280 1/20 0.33
GAA P10253 1/20 0.33
CYP4F2 P78329 1/20 0.33
CYP4A11 Q02928 1/20 0.33

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
SCHEMBL10407235 0.85 SMN1; SMN2 (0.43) SMN1; SMN2KAT2BHPGDMEN1KMT2A
SCHEMBL10408297 0.83 HPGD (0.41) SMN1; SMN2HPGDMEN1KMT2ATDP1
SCHEMBL9832361 0.82 SMN1; SMN2 (0.41) SMN1; SMN2HPGDKMT2AKDM4ELTA4H
SCHEMBL9829977 0.81 SMN1; SMN2 (0.42) SMN1; SMN2KAT2BHPGDMEN1KMT2A
SCHEMBL9829362 0.81 SMN1; SMN2 (0.39) SMN1; SMN2KAT2BHPGDMEN1KMT2A
SCHEMBL10407538 0.81 HPGD (0.41) SMN1; SMN2HPGDMEN1KMT2ATDP1
SCHEMBL10407524 0.80 SMN1; SMN2 (0.46) SMN1; SMN2HPGDMEN1KMT2ALTA4H
SCHEMBL10407410 0.79 CETP (0.45) SMN1; SMN2HPGDKMT2AALOX5TSHR
SCHEMBL9829895 0.78 SMN1; SMN2 (0.39) SMN1; SMN2MEN1KMT2AKDM4ELTA4H
SCHEMBL9830014 0.78 SMN1; SMN2 (0.39) SMN1; SMN2HPGDKMT2ALTA4HALOX5

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