SCHEMBL167755

SCHEMBL167755

CC(C)Oc1c(C(N)=O)n[nH]c1-c1ccc(F)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 1/20 0.39
HAO2 Q9NYQ3 1/20 0.38
LRRK2 Q5S007 1/20 0.38
KDM4E B2RXH2 2/20 0.37
HPGD P15428 2/20 0.37
GAA P10253 1/20 0.37
CDC7 O00311 1/20 0.37
FPR2 P25090 1/20 0.36
SCN9A Q15858 1/20 0.36
ALDH1A1 P00352 1/20 0.36
TSHR P16473 1/20 0.36
HSD17B10 Q99714 1/20 0.36
APOBEC3G Q9HC16 1/20 0.36
TUBB4A P04350 1/20 0.36
TUBB P07437 1/20 0.36
TUBA3C P0DPH7 1/20 0.36
TUBA1B P68363 1/20 0.36
TUBA4A P68366 1/20 0.36
TUBB4B P68371 1/20 0.36
TUBB3 Q13509 1/20 0.36

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
SCHEMBL168203 0.85 TUBB4A (0.43) HAO2CDC7TUBB4ATUBBTUBA3C
SCHEMBL164284 0.79 MAPK1 (0.39) HAO2MAPT
SCHEMBL20074772 0.76 HAO2 (0.42) HAO2MAPK14MAPT
SCHEMBL166629 0.73 CDC7 (0.39) CDC7ALDH1A1MAPK14MKNK2GAK
SCHEMBL29812726 0.73 LRRK2 (0.42) IRAK4LRRK2KDM4EHPGDFPR2
SCHEMBL20075637 0.73 GABRA2 (0.43) KDM4EHPGDALDH1A1MAPK14MAPT
SCHEMBL8694104 0.69 TRPV1 (0.42) MAPK14
SCHEMBL4964605 0.67 HAO2 (0.53) HAO2MAPT
SCHEMBL29812163 0.66 HAO2 (0.52) HAO2KDM4EHPGDALDH1A1MKNK2
SCHEMBL30078099 0.66 AXL (0.41) HAO2LRRK2KDM4EHPGDCDC7

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-2609091-A1 PHARMACEUTICALLY ACTIVE COMPOUNDS AS AXL INHIBITORS Lead Discovery Center GmbH (DE) 2013-07-03 EP disclosed
WO-2012028332-A1 PHARMACEUTICALLY ACTIVE COMPOUNDS AS AXL INHIBITORS LEAD DISCOVERY CENTER GMBH (DE) 2012-03-08 WO disclosed