SCHEMBL11235862

SCHEMBL11235862

CCOC(=O)c1cn(CCF)c2c(F)c(C)c(F)cc2c1=O

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
STAT3 P40763 3/20 0.54
KMT2A Q03164 1/20 0.54
KDM4E B2RXH2 4/20 0.52
ALDH1A1 P00352 4/20 0.48
HPGD P15428 2/20 0.48
HSD17B10 Q99714 2/20 0.48
LMNA P02545 1/20 0.46
TDP1 Q9NUW8 1/20 0.45
HTT P42858 2/20 0.44
ADRB2 P07550 1/20 0.44
POLB P06746 1/20 0.43
CYP1A2 P05177 1/20 0.41
PKM P14618 1/20 0.39
BAZ2B Q9UIF8 1/20 0.39
BAZ2A Q9UIF9 1/20 0.39

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
SCHEMBL5258333 0.93 STAT3 (0.62) STAT3KMT2AKDM4EALDH1A1HPGD
SCHEMBL10518799 0.92 STAT3 (0.53) STAT3KMT2AKDM4EALDH1A1HPGD
SCHEMBL11229199 0.91 KMT2A (0.56) STAT3KMT2AKDM4EALDH1A1HPGD
SCHEMBL10619432 0.88 KMT2A (0.53) STAT3KMT2AKDM4EALDH1A1HPGD
SCHEMBL10330760 0.85 KDM4E (0.68) KMT2AKDM4EALDH1A1HPGDHSD17B10
SCHEMBL31151754 0.85 STAT3 (0.54) STAT3KMT2AKDM4EALDH1A1HPGD
SCHEMBL16026588 0.85 STAT3 (0.54) STAT3KMT2AKDM4EALDH1A1HPGD
SCHEMBL10517272 0.85 STAT3 (0.53) STAT3KMT2AKDM4EALDH1A1HPGD
SCHEMBL11193162 0.85 STAT3 (0.61) STAT3KMT2AKDM4EALDH1A1HPGD
SCHEMBL9636784 0.84 KDM4E (0.76) STAT3KMT2AKDM4EALDH1A1HPGD

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
EP-0028698-B1 QUINOLINE COMPOUNDS, PROCESS FOR THEIR PREPARATION, AND PHARMACEUTICAL COMPOSITIONS Tanabe Seiyaku Co., Ltd. (JP) 1982-12-22 EP disclosed
US-4327101-A Quinoline compound useful as antibacterial agents in warm-blooded animals TANABE SEIKAKU CO., LTD. (JP) 1982-04-27 US disclosed
EP-0028698-A1 Quinoline compounds, process for their preparation, and pharmaceutical compositions Tanabe Seiyaku Co., Ltd. (JP) 1981-05-20 EP disclosed