SCHEMBL3246162

SCHEMBL3246162

CCOC(=O)Oc1c[nH]c2c(=O)[nH]c3ccc(-c4ccc(Cl)nc4)cc3c12

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 2/20 0.37
TLR7 Q9NYK1 2/20 0.37
CSF1R P07333 2/20 0.36
HPGD P15428 4/20 0.34
ALDH1A1 P00352 3/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
HSD17B10 Q99714 2/20 0.34
TP53 P04637 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
GABRA1 P14867 3/20 0.34
GABRG2 P18507 3/20 0.34
GABRB3 P28472 3/20 0.34
GABRA5 P31644 3/20 0.34
GABRA3 P34903 3/20 0.34
GABRA2 P47869 3/20 0.34
GABRP O00591 2/20 0.34
GABRD O14764 2/20 0.34
GABRB1 P18505 2/20 0.34
GABRB2 P47870 2/20 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
SCHEMBL3250859 0.88 RIOK2 (0.45) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL3250544 0.85 MMP2 (0.48) TLR8TLR7CYP1A2CYP2C9CYP2C19
SCHEMBL3249879 0.85 JAK2 (0.42) CSF1RHPGDALDH1A1MEN1KMT2A
SCHEMBL3252380 0.85 CSF1R (0.43) CSF1RHPGDALDH1A1MEN1KMT2A
SCHEMBL3253850 0.84 SCN9A (0.38) CSF1RHPGDALDH1A1MEN1KMT2A
SCHEMBL3249865 0.83 KDM4E (0.40) HPGDALDH1A1MEN1KMT2AHSD17B10
SCHEMBL3254886 0.83 PAK1 (0.42) CSF1RHPGDALDH1A1MEN1KMT2A
SCHEMBL3244562 0.82 CCNC (0.38) HPGDALDH1A1MEN1KMT2AHSD17B10
SCHEMBL3252050 0.82 GAA (0.40) CSF1RHPGDALDH1A1MEN1KMT2A
SCHEMBL3250692 0.82 HPGD (0.34) CSF1RHPGDALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1899335-B1 PYRROLOQUINOLINE DERIVATIVES AND THEIR USE AS PROTEIN KINASE INHIBITORS PF MEDICAMENT (FR) 2010-05-19 EP claimed