SCHEMBL6209508

SCHEMBL6209508

O=CN(c1ccccc1)c1ccc(NCCO)o1

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RECQL P46063 2/20 0.33
MAPK1 P28482 2/20 0.33
CDC25A P30304 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
KDM4E B2RXH2 3/20 0.32
GLA P06280 2/20 0.32
MITF O75030 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
TTR P02766 1/20 0.32
POLB P06746 1/20 0.32
GAA P10253 1/20 0.32
RAD52 P43351 1/20 0.32
RAB9A P51151 1/20 0.32
TOP2B Q02880 1/20 0.31
MCL1 Q07820 1/20 0.31

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
SCHEMBL6210539 0.83 SMN1; SMN2 (0.32) RECQLMAPK1MEN1KMT2AKDM4E
SCHEMBL6170989 0.79 TOP2A (0.30) GAA
SCHEMBL6210018 0.76 RECQL (0.33) RECQLMAPK1CDC25AALDH1A1
SCHEMBL6204656 0.76
SCHEMBL6237029 0.75
SCHEMBL6206130 0.75 ADORA2A (0.33)
SCHEMBL6206185 0.70 ALDH1A1 (0.33) ALDH1A1POLB
SCHEMBL6168559 0.69 KDM4E (0.31) KDM4EALDH1A1
SCHEMBL6208343 0.67 CHRNA4 (0.35) RECQLMAPK1CDC25AKDM4EGLA
SCHEMBL6207829 0.67

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1498109-A1 Furan derivatives and dyeing composition comprising a furan derivative as coupler L'OREAL (FR) 2005-01-19 EP claimed
EP-1498109-A1 Furan derivatives and dyeing composition comprising a furan derivative as coupler L'OREAL (FR) 2005-01-19 EP disclosed