SCHEMBL7998732

SCHEMBL7998732

CCCCOc1c(O)c2ccc(NCC=C(C)CCC=C(C)C)cc2n(CCCC)c1=O

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
CNR2 P34972 2/20 0.36
NPC1 O15118 1/20 0.35
TRPV1 Q8NER1 3/20 0.35
ALDH1A1 P00352 2/20 0.34
KDM4E B2RXH2 2/20 0.34
LMNA P02545 2/20 0.34
HPGD P15428 1/20 0.34
TYMS P04818 1/20 0.34

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
SCHEMBL7998728 1.00 MEN1 (0.36) MEN1KMT2ASMN1; SMN2CNR2NPC1
SCHEMBL8004543 0.97 MEN1 (0.35) MEN1KMT2ASMN1; SMN2CNR2TYMS
SCHEMBL7998905 0.97 MEN1 (0.35) MEN1KMT2ASMN1; SMN2CNR2TYMS
SCHEMBL7998900 0.97 MEN1 (0.35) MEN1KMT2ASMN1; SMN2CNR2TYMS
SCHEMBL8001385 0.91 NPC1 (0.35) MEN1KMT2ACNR2NPC1TRPV1
SCHEMBL8000539 0.91 NPC1 (0.35) MEN1KMT2ACNR2NPC1TRPV1
SCHEMBL8000543 0.91 NPC1 (0.35) MEN1KMT2ACNR2NPC1TRPV1
SCHEMBL8001379 0.91 NPC1 (0.35) MEN1KMT2ACNR2NPC1TRPV1
SCHEMBL7997511 0.90 TDP1 (0.39) MEN1KMT2ANPC1TRPV1ALDH1A1
SCHEMBL7997509 0.90 TDP1 (0.39) MEN1KMT2ANPC1TRPV1ALDH1A1

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
US-6114352-A Quinolinone derivative and anti-allergic agent with said quinolinone derivative as the active ingredient DAINIPPON INK AND CHEMICALS, INC. (JP) 2000-09-05 US disclosed
EP-0785190-B1 Quinolinone derivative and antiallergic agent with said quinolinone derivative as the active ingredient DAINIPPON INK & CHEMICALS (JP) 2000-08-16 EP disclosed
US-5942521-A Quinolinone derivative and anti-allergic agent with said quinolinone derivative as the active ingredient DAINIPPON INK AND CHEMICALS, INC. (JP) 1999-08-24 US disclosed
EP-0785190-A2 Quinolinone derivative and antiallergic agent with said quinolinone derivative as the active ingredient DAINIPPON INK AND CHEMICALS, INC. (JP) 1997-07-23 EP disclosed