SCHEMBL11749070

SCHEMBL11749070

FC(F)(F)c1ccc(-c2nc(S)oc2-c2ccc(C(F)(F)F)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ KIF11 P52732 4/20 0.41
▸ NR4A2 P43354 1/20 0.40
▸ MKNK1 Q9BUB5 1/20 0.39
▸ MKNK2 Q9HBH9 1/20 0.39
▸ NOTUM Q6P988 1/20 0.38
▸ PTPN1 P18031 1/20 0.37
▸ TRPV1 Q8NER1 1/20 0.37
▸ MAPK14 Q16539 1/20 0.37
▸ IKBKB O14920 1/20 0.37
▸ GSR P00390 1/20 0.37
▸ GFER P55789 1/20 0.37
▸ RXRA P19793 3/20 0.36
▸ RXRB P28702 3/20 0.36
▸ RXRG P48443 3/20 0.36
▸ PPARD Q03181 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
SCHEMBL11747487 0.94 KMT2A (0.54) MEN1KMT2AKIF11NR4A2MAPK14
SCHEMBL11755719 0.94 KMT2A (0.54) MEN1KMT2AKIF11NR4A2MAPK14
SCHEMBL11751391 0.92 STAT3 (0.42) MEN1KMT2AKIF11RXRARXRB
SCHEMBL11753479 0.92 STAT3 (0.42) MEN1KMT2AKIF11RXRARXRB
SCHEMBL11753859 0.83 NPC1 (0.40) KMT2AKIF11NR4A2NOTUMMAPK14
SCHEMBL11755256 0.80 MAPK14 (0.50) NR4A2MAPK14
SCHEMBL11755633 0.79 MEN1 (0.44) MEN1KMT2AKIF11NR4A2MKNK1
SCHEMBL11749410 0.77 NR4A2 (0.47) MEN1KMT2ANR4A2MAPK14GFER
SCHEMBL11755115 0.77 RXRA (0.46) MEN1KMT2ANR4A2MAPK14RXRA
SCHEMBL11751140 0.77 KMT2A (0.40) MEN1KMT2ANR4A2RXRARXRB

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-4051250-A OXAZOLE, THIAZOLE MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DT) 1977-09-27 — — US disclosed
US-3933840-A ANTIPHLOGISTIC MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DT) 1976-01-20 — — US disclosed
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