SCHEMBL25283142

SCHEMBL25283142

CC(=O)c1c(O)ccc2cccnc12.COCOc1cnc2ccoc2c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 4/20 0.35
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
KCNA3 P22001 1/20 0.34
ALDH1A1 P00352 1/20 0.33
RAB9A P51151 3/20 0.33
L3MBTL1 Q9Y468 3/20 0.33
KDM4E B2RXH2 2/20 0.33
NPC1 O15118 2/20 0.33
LMNA P02545 2/20 0.33
TP53 P04637 2/20 0.33
HTT P42858 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
ALOX12 P18054 1/20 0.33
MAPK1 P28482 1/20 0.33
MITF O75030 1/20 0.33
ERN1 O75460 1/20 0.32
NSD2 O96028 1/20 0.32
CASP3 P42574 1/20 0.32
CASP7 P55210 1/20 0.32

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
SCHEMBL31022641 0.76 KDM4E (0.34) KDM4E
SCHEMBL31022679 0.73 ERN1 (0.54) EGLN1ALDH1A1L3MBTL1KDM4ELMNA
SCHEMBL25238932 0.64
SCHEMBL12814747 0.63 KDM4E (0.45) MEN1KMT2AALDH1A1RAB9AKDM4E
SCHEMBL31022701 0.62 CA12 (0.57) EGLN1KMT2AALDH1A1RAB9AL3MBTL1
SCHEMBL25235346 0.62 CA12 (0.57) EGLN1KMT2AALDH1A1RAB9AL3MBTL1
SCHEMBL16040593 0.62 ALDH1A1 (0.60) EGLN1MEN1KMT2AALDH1A1L3MBTL1
SCHEMBL31057838 0.62 ALDH1A1 (0.60) EGLN1MEN1KMT2AALDH1A1L3MBTL1
SCHEMBL8564487 0.61 CYP1A2 (0.50) KMT2AALDH1A1RAB9AKDM4ENPC1
SCHEMBL7893039 0.60 CYP3A4 (0.55) MEN1KMT2AALDH1A1KDM4ESMN1; SMN2

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023120696-A1 1H-PYRAZOLE-3-AMINE DERIVATIVE HAVING BICYCLIC BACKBONE 住友ファーマ株式会社 2023-06-29 WO disclosed