SCHEMBL11249360

SCHEMBL11249360

CCOC(=O)c1cnc2c(C)cccc2c1O

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.57
KMT2A Q03164 4/20 0.57
ALDH1A1 P00352 3/20 0.57
MEN1 O00255 3/20 0.57
KDM4E B2RXH2 2/20 0.57
TSHR P16473 1/20 0.57
HSD17B10 Q99714 1/20 0.57
TP53 P04637 1/20 0.56
POLB P06746 1/20 0.53
GAA P10253 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
LMNA P02545 1/20 0.53
HTT P42858 1/20 0.53
MAPK1 P28482 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
NPC1 O15118 1/20 0.52
RAB9A P51151 1/20 0.52

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
SCHEMBL6200113 0.89 CCR6 (0.54) MAPTKMT2AALDH1A1MEN1KDM4E
SCHEMBL9814048 0.88 KMT2A (0.51) MAPTKMT2AALDH1A1MEN1KDM4E
SCHEMBL7938727 0.86 KMT2A (0.50) MAPTKMT2AALDH1A1MEN1KDM4E
SCHEMBL4152010 0.86 KMT2A (0.56) MAPTKMT2AALDH1A1MEN1KDM4E
SCHEMBL3061001 0.86 KMT2A (0.50) MAPTKMT2AALDH1A1MEN1KDM4E
SCHEMBL4152079 0.86 MAPT (0.52) MAPTKMT2AMEN1HSD17B10TP53
SCHEMBL11235620 0.86 MEN1 (0.57) MAPTKMT2AMEN1KDM4ELMNA
SCHEMBL31681091 0.85 MEN1 (0.68) MAPTKMT2AALDH1A1MEN1KDM4E
SCHEMBL4721440 0.85 MEN1 (0.68) MAPTKMT2AALDH1A1MEN1KDM4E
SCHEMBL438878 0.85 KMT2A (0.71) MAPTKMT2AALDH1A1MEN1KDM4E

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
CN-114751858-B Quinolinyl-containing tranexamic acid derivative and preparation and application thereof 沈阳药科大学 2023-09-12 CN disclosed
CN-114751858-A Quinolinyl-containing tranexamic acid derivative, preparation and application thereof 沈阳药科大学 2022-07-15 CN disclosed
US-4343804-A 4-Amino-3-quinolinecarboxylic acids and esters-antisecretory anti-ulcer compounds A. H. ROBINS COMPANY, INC. (US) 1982-08-10 US disclosed