SCHEMBL8346113

SCHEMBL8346113

Oc1cnc(-c2cc(Cl)ccc2F)nc1Cl

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 1/20 0.38
PRKD3 O94806 1/20 0.38
TGFBR1 P36897 1/20 0.38
PRKD1 Q15139 1/20 0.38
PRKD2 Q9BZL6 1/20 0.38
IDO1 P14902 6/20 0.37
EPHX2 P34913 1/20 0.37
CYP19A1 P11511 1/20 0.37
KMO O15229 1/20 0.35
ALDH1A1 P00352 2/20 0.34
P2RX1 P51575 1/20 0.34
KDM4E B2RXH2 1/20 0.34
TLR4 O00206 1/20 0.34
TSHR P16473 2/20 0.33
HSD17B10 Q99714 2/20 0.33
HTR2B P41595 1/20 0.33
PDE4D Q08499 1/20 0.33
CYP3A4 P08684 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
AURKA O14965 1/20 0.33

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
SCHEMBL3838556 0.78 TGFBR1 (0.47) PRKD3TGFBR1PRKD1PRKD2PDE4D
SCHEMBL3822929 0.78 TGFBR1 (0.36) PIM1PRKD3TGFBR1PRKD1PRKD2
SCHEMBL16424417 0.78 TGFBR1 (0.37) PRKD3TGFBR1PRKD1PRKD2IDO1
SCHEMBL3838487 0.77 PDE4D (0.36) PRKD3TGFBR1PRKD1PRKD2HTR2B
SCHEMBL8344312 0.77 MAPT (0.46) TGFBR1ALDH1A1KDM4ETDP1
SCHEMBL8347937 0.77 TGFBR1 (0.36) PRKD3TGFBR1PRKD1PRKD2PDE4D
SCHEMBL21190043 0.76 TGFBR1 (0.45) PRKD3TGFBR1PRKD1PRKD2EPHX2
SCHEMBL8347188 0.76 TGFBR1 (0.43) PRKD3TGFBR1PRKD1PRKD2IDO1
SCHEMBL3824986 0.75 MAPT (0.42) PIM1PRKD3TGFBR1PRKD1PRKD2
SCHEMBL13649273 0.75 FGFR4 (0.42) TGFBR1ALDH1A1KDM4EAURKA

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-2004024159-A1 INHIBITORS OF TFGβ SCIOS INC. (US) 2004-03-25 WO disclosed