SCHEMBL11635971

SCHEMBL11635971

O=C(O)Cn1ccc(=O)c2ccccc21

nearest known ligand 0.65

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.62
KDM4E B2RXH2 4/20 0.53
GLA P06280 1/20 0.53
STAT3 P40763 1/20 0.53
ALDH1A1 P00352 3/20 0.50
APEX1 P27695 1/20 0.49
NR3C1 P04150 1/20 0.47
PGR P06401 1/20 0.47
NR3C2 P08235 1/20 0.47
TBXAS1 P24557 1/20 0.47
MAPT P10636 2/20 0.47
GFER P55789 1/20 0.47
GAA P10253 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
SCHEMBL11148014 0.85 KMT2A (0.47) KMT2AKDM4EGLASTAT3ALDH1A1
SCHEMBL11192940 0.81 KMT2A (0.47) KMT2AKDM4EGLASTAT3ALDH1A1
SCHEMBL29035968 0.81 KDM4E (0.52) KMT2AKDM4EGLASTAT3ALDH1A1
SCHEMBL29696630 0.79 HTR6 (0.55) KMT2AKDM4EALDH1A1MAPT
SCHEMBL17111036 0.79 HTR6 (0.55) KMT2AKDM4EALDH1A1MAPT
SCHEMBL29035976 0.79 RAB9A (0.61) KMT2AKDM4EALDH1A1MAPT
SCHEMBL14564434 0.78 KDM4E (0.47) KMT2AKDM4EALDH1A1TBXAS1MAPT
SCHEMBL4886606 0.77 MEN1 (0.49) KMT2AALDH1A1NR3C1PGRNR3C2
SCHEMBL1598786 0.77 KMT2A (1.00) KMT2AKDM4E
SCHEMBL2851614 0.77 NR3C1 (0.50) KMT2AALDH1A1NR3C1PGRNR3C2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115232070-A Quinolinone alkaloid derivative containing acylhydrazone group on 1-site nitrogen atom and preparation method and application thereof 太原理工大学 2022-10-25 CN claimed
CN-103524410-A 4-quinolone-N-acetic acid molecular crystal and preparation method and application thereof ZHONGSHAN POLYTECHNIC 2014-01-22 CN disclosed
US-4119775-A ANTIBACTERIAL RICHARDSON-MERRELL INC. (US) 1978-10-10 US disclosed
US-3989687-A ANTIBACTERIAL RICHARDSON-MERRELL INC. (US) 1976-11-02 US disclosed