SCHEMBL11428536

SCHEMBL11428536

Cn1cc(-c2cccc(I)c2)c(=O)c(-c2cccc(C(F)(F)F)c2)c1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ BRD9 Q9H8M2 1/20 0.41
▸ ALOX15 P16050 1/20 0.39
▸ ALOX12 P18054 1/20 0.39
▸ SCN9A Q15858 2/20 0.39
▸ AKR1C3 P42330 1/20 0.38
▸ AKR1C2 P52895 1/20 0.38
▸ TGFBR1 P36897 1/20 0.38
▸ MAOB P27338 1/20 0.38
▸ RORC P51449 1/20 0.38
▸ RORB Q92753 1/20 0.38
▸ NOTUM Q6P988 1/20 0.37
▸ PARP10 Q53GL7 1/20 0.37
▸ PARP11 Q9NR21 1/20 0.37
▸ KCNA3 P22001 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ PGR P06401 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
SCHEMBL11433951 0.92 BRD9 (0.46) BRD9ALOX15ALOX12SCN9AAKR1C3
Fluridone SCHEMBL6751451 0.87 BRD9 (0.43) BRD9ALOX15ALOX12SCN9AAKR1C3
Fluridone SCHEMBL54579 0.87 BRD9 (0.43) BRD9ALOX15ALOX12SCN9AAKR1C3
SCHEMBL11426704 0.86 BRD9 (0.43) BRD9ALOX15ALOX12SCN9AAKR1C3
SCHEMBL11175526 0.85 PTPN5 (0.46) BRD9ALOX15ALOX12SCN9AKCNA3
SCHEMBL11435975 0.85 BRD9 (0.42) BRD9ALOX15ALOX12SCN9AAKR1C3
SCHEMBL11428587 0.84 PGR (0.43) BRD9ALOX15ALOX12SCN9AAKR1C3
SCHEMBL11435071 0.84 BRD9 (0.44) BRD9ALOX15ALOX12SCN9AAKR1C3
SCHEMBL11429488 0.84 ALOX15 (0.42) BRD9ALOX15ALOX12SCN9AAKR1C3
SCHEMBL11429556 0.84 MAPT (0.47) BRD9ALOX15ALOX12SCN9ARORC

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
US-4235619-A USING 3-PHENYL-4(1H)-PYRIDONES OR PYRIDINETHIONES ELI LILLY AND COMPANY (US) 1980-11-25 — — US disclosed
US-4152136-A HERBICIDES ELI LILLY AND COMPANY (US) 1979-05-01 — — US disclosed
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