SCHEMBL6919910

SCHEMBL6919910

O=c1[nH]c2ccc(Br)cc2c(F)c1-c1ccncc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 4/20 0.51
CHUK O15111 1/20 0.46
PADI4 Q9UM07 2/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
CSF1R P07333 2/20 0.42
PDE2A O00408 1/20 0.42
ALDH1A1 P00352 2/20 0.41
TSHR P16473 1/20 0.41
CASP7 P55210 1/20 0.41
HSD17B10 Q99714 1/20 0.41
CDK5 Q00535 4/20 0.41
GSK3A P49840 2/20 0.41
GSK3B P49841 2/20 0.41
CHEK1 O14757 1/20 0.41
AURKA O14965 1/20 0.41
DAPK3 O43293 1/20 0.41
JAK2 O60674 1/20 0.41
PRKD3 O94806 1/20 0.41
MAP4K4 O95819 1/20 0.41

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
SCHEMBL6825083 0.82 GRIN2D (0.41) MAPK14PADI4MEN1KMT2ACSF1R
SCHEMBL6824577 0.80 ALDH1A1 (0.47) MEN1KMT2ACSF1RALDH1A1GSK3A
SCHEMBL6825750 0.76 PDE2A (0.58) MAPK14MEN1KMT2ACSF1RPDE2A
SCHEMBL1612248 0.74 IMPDH2 (0.62) CHUKMEN1KMT2ACSF1RALDH1A1
SCHEMBL3117686 0.72 KDM4E (0.54) MAPK14CHUKMEN1KMT2ACSF1R
SCHEMBL6821955 0.70 PADI4 (0.55) MAPK14CHUKPADI4CSF1RALDH1A1
SCHEMBL17457312 0.70 CSF1R (0.70) MAPK14CSF1RCDK5GSK3AGSK3B
SCHEMBL15648185 0.69 KDM4E (0.70) MEN1KMT2AALDH1A1TSHRCASP7
SCHEMBL9042203 0.69 CHUK (0.59) MAPK14CHUKPADI4MEN1KMT2A
SCHEMBL21812474 0.68 CHUK (0.50) MAPK14CHUKCSF1RALDH1A1CDK5

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
WO-2004089930-A1 4-FLUOROQUINOLONE DERIVATIVES AND THEIR USE AS KINASE INHIBITORS IMCLONE SYSTEMS INCORPORATED (US) 2004-10-21 WO disclosed