SCHEMBL30216608

SCHEMBL30216608

COc1cc2nccc(Oc3ccc(Nc4nn(C)cc4C(=O)NC4CCCCC4)cc3)c2cc1OC

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ AXL P30530 15/20 1.00
▸ RET P07949 5/20 0.87
▸ KIT P10721 2/20 0.67
▸ STK10 O94804 1/20 0.67
▸ CSF1R P07333 1/20 0.67
▸ PDGFRB P09619 1/20 0.67
▸ FLT1 P17948 1/20 0.67
▸ TIE1 P35590 1/20 0.67
▸ FLT4 P35916 1/20 0.67
▸ FLT3 P36888 1/20 0.67
▸ TEK Q02763 1/20 0.67
▸ MERTK Q12866 1/20 0.67
▸ PDGFRA P16234 1/20 0.65

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
SCHEMBL21408207 1.00 AXL (1.00) AXLRETKITSTK10CSF1R
SCHEMBL21432109 0.92 AXL (1.00) AXLRETKITSTK10CSF1R
SCHEMBL21432108 0.90 AXL (1.00) AXLRETKITSTK10CSF1R
SCHEMBL28533834 0.90 AXL (0.82) AXLRETKITSTK10CSF1R
SCHEMBL21408222 0.89 AXL (0.88) AXLRETKITSTK10CSF1R
SCHEMBL21408218 0.89 AXL (1.00) AXLRETKITSTK10CSF1R
SCHEMBL21408216 0.89 AXL (1.00) AXLRETKITSTK10CSF1R
SCHEMBL21408210 0.89 AXL (1.00) AXLRETKITSTK10CSF1R
SCHEMBL21431939 0.89 AXL (0.81) AXLRETKITSTK10CSF1R
SCHEMBL30216583 0.89 AXL (1.00) AXLRETKITSTK10CSF1R

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
CN-112313213-B 3-amino pyrazole compound and application thereof 上海海和药物研究开发股份有限公司 2023-01-31 — — CN claimed
CN-112313213-B 3-amino pyrazole compound and application thereof 上海海和药物研究开发股份有限公司 2023-01-31 — — CN disclosed
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