SCHEMBL28629567

SCHEMBL28629567

Cc1ccc2cc(-c3ccccc3)[nH]c(=O)c2c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.59
HPGD P15428 5/20 0.59
RAB9A P51151 4/20 0.59
NPC1 O15118 3/20 0.59
LMNA P02545 2/20 0.59
SMN1; SMN2 Q16637 2/20 0.59
MAPT P10636 2/20 0.59
TP53 P04637 1/20 0.59
HSD17B10 Q99714 1/20 0.59
GAA P10253 4/20 0.49
ALDH1A1 P00352 3/20 0.49
TNKS O95271 3/20 0.49
CYP1A2 P05177 1/20 0.49
CYP3A4 P08684 1/20 0.49
CYP2C19 P33261 1/20 0.49
PARP1 P09874 3/20 0.49
PIM1 P11309 1/20 0.47
TNKS2 Q9H2K2 2/20 0.47
MEN1 O00255 1/20 0.46
MAPK1 P28482 1/20 0.46

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
SCHEMBL30160749 1.00 KDM4E (0.59) KDM4EHPGDRAB9ANPC1LMNA
SCHEMBL14867343 0.90 HPGD (0.57) KDM4EHPGDRAB9ANPC1LMNA
SCHEMBL14867268 0.84 KDM4E (0.48) KDM4EHPGDRAB9ANPC1LMNA
SCHEMBL14867282 0.84 KDM4E (0.48) KDM4EHPGDRAB9ANPC1LMNA
SCHEMBL14867302 0.82 TNKS (0.53) TNKS
SCHEMBL28924699 0.82 TNKS (0.65) KDM4EHPGDRAB9ANPC1LMNA
SCHEMBL30161077 0.82 TNKS (0.65) KDM4EHPGDRAB9ANPC1LMNA
SCHEMBL4769828 0.82 KDM4E (0.63) KDM4EHPGDRAB9ANPC1LMNA
SCHEMBL16625064 0.82 TNKS (0.48) KDM4EHPGDRAB9ANPC1LMNA
SCHEMBL828493 0.81 TNKS (0.63) KDM4EHPGDRAB9ANPC1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115521310-A Synthesis method of isoindole isoquinoline spironaphthone compound 河南师范大学 2022-12-27 CN disclosed
CN-110041257-B Method for synthesizing indene spiro indene [1,2-c ] isoquinoline triketone compound 河南师范大学 2021-08-03 CN disclosed