SCHEMBL6577045

SCHEMBL6577045

CCOC(=O)c1ccc(N(C)C)cc1NC

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.52
KMT2A Q03164 2/20 0.52
MEN1 O00255 1/20 0.52
CA12 O43570 2/20 0.45
CA1 P00915 2/20 0.45
CA2 P00918 2/20 0.45
CA7 P43166 2/20 0.45
CA9 Q16790 2/20 0.45
CA14 Q9ULX7 2/20 0.45
SMN1; SMN2 Q16637 4/20 0.45
MAPT P10636 4/20 0.45
ALDH1A1 P00352 4/20 0.45
LMNA P02545 4/20 0.45
NPC1 O15118 2/20 0.45
MAPK1 P28482 2/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
TSHR P16473 4/20 0.45
GAA P10253 1/20 0.44
RECQL P46063 1/20 0.44
JAK2 O60674 1/20 0.44

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
SCHEMBL11669735 0.83 TSHR (0.56) RAB9AKMT2AMEN1CA12CA1
SCHEMBL11815650 0.80 CA12 (0.54) RAB9AKMT2AMEN1CA12CA1
SCHEMBL28057743 0.80 CA12 (0.49) KMT2AMEN1CA12CA1CA2
SCHEMBL4440051 0.79 ALDH1A1 (0.57) RAB9AKMT2AMEN1CA12CA1
SCHEMBL14217003 0.79 MAPK1 (0.52) KMT2AMEN1CA12CA1CA2
SCHEMBL11669017 0.79 TSHR (0.51) RAB9AKMT2AMEN1CA12CA1
Hydrochloric Acid SCHEMBL6382375 0.78 KDM4E (0.52) KMT2AMEN1CA12CA1CA2
SCHEMBL8897725 0.78 TSHR (0.52) KMT2AMEN1CA12CA1CA2
Hydrochloric Acid SCHEMBL6382400 0.77 KDM4E (0.52) RAB9ACA12CA1CA2CA7
SCHEMBL6578899 0.76 MCL1 (0.45) KMT2ACA12CA1CA2CA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1161337-C Chinolinelone derivative, its prepn. method and antiabnormal reaction agent ���ձ���ī��ѧ��ҵ��ʽ���� 2004-08-11 CN disclosed
EP-0927718-B1 Quinolinone derivative, method for preparing the same, and anti-allergic agent DAINIPPON INK & CHEMICALS (JP) 2004-02-25 EP disclosed
US-6271416-B1 O-(HYDROCARBONOXYACETAMIDO)BENZOIC ACID DERIVATIVES AS INTERMEDIATES DAINIPPON INK AND CHEMICALS, INC. (JP) 2001-08-07 US disclosed
US-6136822-A ETHER, HYDROXY QUINOLINONE COMPOUNDS DAINIPPON INK AND CHEMICALS, INC. (JP) 2000-10-24 US disclosed
EP-0927718-A1 Quinolinone derivative, method for preparing the same, and anti-allergic agent DAINIPPON INK AND CHEMICALS, INC. (JP) 1999-07-07 EP disclosed