SCHEMBL29633976

SCHEMBL29633976

COc1ccc(Cl)cc1-c1cccc(F)c1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 3/20 0.51
PTGES2 Q9H7Z7 1/20 0.46
PDE4D Q08499 1/20 0.46
MAPK10 P53779 1/20 0.46
ERN1 O75460 1/20 0.46
CTSA P10619 3/20 0.45
PDGFRB P09619 1/20 0.44
PDGFRA P16234 1/20 0.44
KIT P10721 1/20 0.44
NR3C1 P04150 1/20 0.44
PGR P06401 1/20 0.44
FYN P06241 3/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
AGPAT2 O15120 1/20 0.43
PTGS1 P23219 1/20 0.43
NFE2L2 Q16236 1/20 0.43

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
SCHEMBL5099550 0.86 PDE4D (0.56) PDE4BPTGES2PDE4DMAPK10ERN1
SCHEMBL24518295 0.82 PTGES2 (0.47) PDE4BPTGES2PDE4DMAPK10ERN1
SCHEMBL3759371 0.81 PTGDR2 (0.57) PTGES2PDE4DMAPK10ERN1SMN1; SMN2
SCHEMBL29634149 0.81 PTGDR2 (0.57) PTGES2PDE4DMAPK10ERN1SMN1; SMN2
SCHEMBL15425109 0.80 KDM4E (0.55) MAPK10FYNNPC1RAB9ASMN1; SMN2
SCHEMBL24017210 0.80 FYN (0.56) PDE4BPDGFRBPDGFRAFYN
SCHEMBL31067143 0.79 MEN1 (0.46) CTSARAB9A
SCHEMBL20898099 0.79 MEN1 (0.46) CTSARAB9A
SCHEMBL16574087 0.78 MEN1 (0.43) AGPAT2
SCHEMBL20573238 0.78 PTGDR2 (0.45) PDE4D

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-113214178-B 3-aryl substituted anthranilic anhydride derivative and preparation method thereof 广东工业大学 2022-05-13 CN disclosed