SCHEMBL7980736

SCHEMBL7980736

CCOC(=O)c1cc(NCc2ccccc2)ccc1N(C)C(=O)COc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.47
NPSR1 Q6W5P4 1/20 0.47
SENP1 Q9P0U3 1/20 0.47
TSHR P16473 1/20 0.47
MAPK10 P53779 1/20 0.47
ALDH1A1 P00352 6/20 0.46
MAPT P10636 6/20 0.46
LMNA P02545 3/20 0.46
HPGD P15428 3/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
SMN1; SMN2 Q16637 5/20 0.45
KDM4E B2RXH2 2/20 0.45
TDP1 Q9NUW8 1/20 0.45
NPC1 O15118 2/20 0.44
HSD17B10 Q99714 1/20 0.44
FFAR1 O14842 3/20 0.43
PKM P14618 1/20 0.43
EGFR P00533 2/20 0.43
ERBB2 P04626 1/20 0.43
HTT P42858 1/20 0.42

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
SCHEMBL6576624 0.86 TSHR (0.50) RAB9ATSHRMAPK10ALDH1A1MAPT
SCHEMBL6579573 0.81 TSHR (0.48) RAB9ATSHRMAPK10ALDH1A1MAPT
SCHEMBL6577225 0.81 SENP1 (0.48) RAB9ANPSR1SENP1TSHRALDH1A1
SCHEMBL7980769 0.79 EGFR (0.46) RAB9ANPSR1SENP1ALDH1A1MAPT
SCHEMBL6581961 0.78 LMNA (0.44) NPSR1TSHRMAPK10ALDH1A1MAPT
SCHEMBL6579566 0.78 TSHR (0.50) RAB9ATSHRMAPK10ALDH1A1MAPT
SCHEMBL1403640 0.77 RAB9A (0.54) RAB9ANPSR1SENP1TSHRALDH1A1
SCHEMBL7980738 0.77 KMT2A (0.53) RAB9ANPSR1SENP1TSHRALDH1A1
SCHEMBL6579783 0.75 TSHR (0.48) RAB9ATSHRMAPK10ALDH1A1MAPT
SCHEMBL6578828 0.72 KMT2A (0.45) RAB9ATSHRALDH1A1LMNAHPGD

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
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