SCHEMBL6208486

SCHEMBL6208486

O=CNc1cc(Cl)c(NCCO)o1

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CDC25A P30304 1/20 0.33
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
TNF P01375 1/20 0.31
IL1B P01584 1/20 0.31
NLRP3 Q96P20 1/20 0.31
RECQL P46063 1/20 0.31
POLB P06746 1/20 0.30
HPGD P15428 1/20 0.30
HTT P42858 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C19 P33261 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL6208343 0.71 CHRNA4 (0.35) CDC25AKDM4ERECQL
SCHEMBL6165859 0.67
SCHEMBL6167489 0.60 ALDH1A3 (0.38) KDM4EALDH1A1MAPTRECQLPOLB
SCHEMBL11597508 0.59 CYP3A4 (0.41) KDM4EMAPTPOLBHTTKMT2A
SCHEMBL10396655 0.57 LMNA (0.46) ALDH1A1MAPTTNFIL1BNLRP3
SCHEMBL28518711 0.56 GPR35 (0.51) KDM4EALDH1A1MAPTKMT2A
SCHEMBL28272953 0.56 ALDH1A1 (0.42) ALDH1A1
SCHEMBL10987001 0.56
SCHEMBL2097678 0.55 ERN1 (0.40) ALDH1A1MAPTRECQLPOLBHPGD
SCHEMBL1664005 0.54 MAPK1 (0.33) KDM4EALDH1A1RECQLPOLBCYP2D6

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