SCHEMBL5334323

SCHEMBL5334323

COc1ccc(OC)c(-c2nc3c(CN(Cc4ccccn4)Cc4ccccn4)cccc3o2)c1

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SYK P43405 4/20 0.45
CHRNA7 P36544 4/20 0.42
ALDH1A1 P00352 4/20 0.41
KDM4E B2RXH2 3/20 0.41
ABCB1 P08183 1/20 0.40
HTR1A P08908 1/20 0.40
DRD2 P14416 1/20 0.40
MAPT P10636 1/20 0.38
RECQL P46063 1/20 0.38
TDP1 Q9NUW8 1/20 0.38

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
SCHEMBL5332439 0.93 SYK (0.42) SYKCHRNA7ALDH1A1KDM4EABCB1
SCHEMBL5339851 0.90 KDM4E (0.39) SYKCHRNA7ALDH1A1KDM4EMAPT
SCHEMBL16156465 0.87 KDM4E (0.43) CHRNA7ALDH1A1KDM4EMAPT
SCHEMBL14436096 0.85 SYK (0.42) SYKCHRNA7ALDH1A1KDM4EABCB1
SCHEMBL16156471 0.83 HSD17B10 (0.45) SYKCHRNA7ALDH1A1KDM4EMAPT
SCHEMBL5340379 0.81 KDM4E (0.44) ALDH1A1KDM4EMAPTRECQL
SCHEMBL5335547 0.79 PTPN1 (0.41) CHRNA7ALDH1A1MAPTTDP1
SCHEMBL5334048 0.78 KDM4E (0.45) SYKALDH1A1KDM4EMAPT
SCHEMBL16156467 0.77 TOP2A (0.49) ALDH1A1KDM4EMAPTTDP1
SCHEMBL5332563 0.75 KDM4E (0.45) SYKALDH1A1KDM4EMAPT

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-7262301-B1 Zinc-chelating ratiometric fluorescent probes and related methods NORTHWESTERN UNIVERSITY (US) 2007-08-28 US disclosed
US-7262301-B1 Zinc-chelating ratiometric fluorescent probes and related methods NORTHWESTERN UNIVERSITY (US) 2007-08-28 US disclosed
US-7105680-B1 Zinc-chelating ratiometric fluorescent probes and related methods NORTHWESTERN UNIVERSITY (US) 2006-09-12 US disclosed