SCHEMBL29623754

SCHEMBL29623754

Cc1cc2ncn(-c3ccc(NC(=O)Nc4cc(C(C)(C)C)on4)cc3)c2cc1C

nearest known ligand 0.61

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 10/20 0.61
MAPK14 Q16539 2/20 0.57
MEN1 O00255 1/20 0.57
NPC1 O15118 1/20 0.57
RAB9A P51151 1/20 0.57
KMT2A Q03164 1/20 0.57
CSF1R P07333 3/20 0.55
RET P07949 1/20 0.53
PDGFRB P09619 1/20 0.53
KIT P10721 1/20 0.53
PDGFRA P16234 1/20 0.53
RAF1 P04049 6/20 0.53
MAPK13 O15264 1/20 0.53
MAPK12 P53778 1/20 0.53
MAPK11 Q15759 1/20 0.53
RIPK2 O43353 1/20 0.52
KDR P35968 1/20 0.51

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
SCHEMBL19350750 1.00 FLT3 (0.61) FLT3MAPK14MEN1NPC1RAB9A
SCHEMBL19350706 0.90 FLT3 (0.61) FLT3MAPK14MEN1NPC1RAB9A
SCHEMBL29623670 0.90 FLT3 (0.61) FLT3MAPK14MEN1NPC1RAB9A
SCHEMBL19350893 0.88 BRAF (0.61) FLT3MAPK14MEN1NPC1RAB9A
SCHEMBL29623368 0.88 BRAF (0.61) FLT3MAPK14MEN1NPC1RAB9A
SCHEMBL19350796 0.88 MAPK14 (0.67) FLT3MAPK14MEN1NPC1RAB9A
SCHEMBL19350883 0.88 FLT3 (0.56) FLT3MAPK14MEN1NPC1RAB9A
SCHEMBL29623488 0.88 MAPK14 (0.67) FLT3MAPK14MEN1NPC1RAB9A
SCHEMBL29623236 0.88 FLT3 (0.56) FLT3MAPK14MEN1NPC1RAB9A
SCHEMBL29623374 0.88 MEN1 (0.63) FLT3MAPK14MEN1NPC1RAB9A

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
CN-109071523-B Urea compound, preparation method and medical application thereof 恩瑞生物医药科技(上海)有限公司 2022-05-31 CN disclosed