SCHEMBL9521073

SCHEMBL9521073

Cc1cc(=O)n(-c2cc(C(=O)O)c(Br)cc2F)c(=O)n1C(F)F

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 4/20 0.35
MYC P01106 4/20 0.34
NR4A1 P22736 1/20 0.34
LCK P06239 1/20 0.32
FYN P06241 1/20 0.32
HSP90AA1 P07900 1/20 0.31
TSHR P16473 1/20 0.30
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL9494830 0.86 NOTUM (0.38) NOTUMMYCNR4A1
SCHEMBL9519992 0.85 PTPN11 (0.31)
SCHEMBL9520198 0.85 TSHR (0.33) LCKFYNTSHRHSD17B10
SCHEMBL9523542 0.76 MAPT (0.35) MYC
SCHEMBL9521572 0.74 LMNA (0.34) NOTUM
SCHEMBL9497433 0.72 CA12 (0.39)
SCHEMBL9522911 0.72 NPC1 (0.31)
SCHEMBL9521004 0.71 NOTUM (0.31) NOTUM
SCHEMBL9522926 0.71 FNTA (0.38)
SCHEMBL9877333 0.71 HPGD (0.44)

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
EP-0323487-B1 HETEROCYCLIC COMPOUNDS CIBA-GEIGY AG (CH) 1993-03-31 EP claimed