SCHEMBL17375830

SCHEMBL17375830

CCOC(=O)c1cnc2c(ccc3ccccc32)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.62
KDM4E B2RXH2 2/20 0.62
MAPK1 P28482 2/20 0.62
L3MBTL1 Q9Y468 1/20 0.62
RAB9A P51151 2/20 0.60
MEN1 O00255 1/20 0.60
NPC1 O15118 1/20 0.60
ALDH1A1 P00352 1/20 0.54
HPGD P15428 1/20 0.54
MAPT P10636 7/20 0.52
TP53 P04637 3/20 0.52
POLB P06746 2/20 0.51
RAD52 P43351 2/20 0.51
UHRF1 Q96T88 1/20 0.49
GAA P10253 1/20 0.49
CDC25B P30305 1/20 0.49
MAOB P27338 2/20 0.48
HCRTR1 O43613 1/20 0.47
ALOX15 P16050 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47

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
SCHEMBL17375869 0.85 PSMD14 (0.64) KMT2AKDM4EMAPK1L3MBTL1RAB9A
SCHEMBL30361283 0.84 KMT2A (0.48) KMT2AKDM4EMAPK1L3MBTL1RAB9A
SCHEMBL27773938 0.84 CCR1 (0.54) KMT2AKDM4EMAPK1L3MBTL1RAB9A
SCHEMBL2201187 0.82 KDM4E (0.55) KMT2AKDM4EMEN1ALDH1A1MAPT
SCHEMBL2203246 0.82 PSMD14 (0.51) KMT2AKDM4EMAPK1L3MBTL1RAB9A
Formaldehyde SCHEMBL27800820 0.82 CCR1 (0.51) KMT2AKDM4EMAPK1L3MBTL1RAB9A
SCHEMBL4155141 0.81 PSMD14 (0.50) KMT2AKDM4EMAPK1L3MBTL1RAB9A
SCHEMBL6537724 0.81 PSMD14 (0.50) KMT2AKDM4EMAPK1L3MBTL1RAB9A
SCHEMBL4150906 0.81 MAOB (0.53) KMT2ARAB9AMEN1NPC1ALDH1A1
SCHEMBL430324 0.80 MGAM (0.59) KMT2AKDM4EMAPK1RAB9AMEN1

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
WO-2015198349-A1 A ONE POT SYNTHESIS OF 3-SUBSTITUTED QUINOLINE CARBOXYLATES AND ITS DERIVATIVES COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2015-12-30 WO claimed
WO-2015198349-A1 A ONE POT SYNTHESIS OF 3-SUBSTITUTED QUINOLINE CARBOXYLATES AND ITS DERIVATIVES COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2015-12-30 WO disclosed
WO-2015198349-A1 A ONE POT SYNTHESIS OF 3-SUBSTITUTED QUINOLINE CARBOXYLATES AND ITS DERIVATIVES COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2015-12-30 WO disclosed