SCHEMBL9515476

SCHEMBL9515476

CCCCCCc1cnc(-c2ccc(OC(F)(F)C(F)C(F)F)cc2)nc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RARB P10826 1/20 0.51
▸ RAB9A P51151 7/20 0.48
▸ MAPT P10636 5/20 0.48
▸ SMN1; SMN2 Q16637 5/20 0.48
▸ KDM4E B2RXH2 2/20 0.48
▸ HSD17B10 Q99714 2/20 0.48
▸ MEN1 O00255 1/20 0.48
▸ USP2 O75604 1/20 0.48
▸ ALDH1A1 P00352 1/20 0.48
▸ GAA P10253 1/20 0.48
▸ HPGD P15428 1/20 0.48
▸ KMT2A Q03164 1/20 0.48
▸ CASP3 P42574 1/20 0.45
▸ SENP8 Q96LD8 1/20 0.45
▸ SENP7 Q9BQF6 1/20 0.45
▸ SENP6 Q9GZR1 1/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ NPC1 O15118 5/20 0.41
▸ STAT3 P40763 1/20 0.38
▸ ATM Q13315 1/20 0.38

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
SCHEMBL9513298 1.00 RARB (0.51) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL9514534 0.99 RARB (0.49) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL9513800 0.95 RARB (0.44) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL9338936 0.92 RARB (0.54) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL10594376 0.92 RARB (0.54) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL9337089 0.92 RARB (0.54) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL9340497 0.92 RARB (0.54) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL9336563 0.92 RARB (0.54) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL9338756 0.92 RARB (0.54) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL9337192 0.90 RARB (0.52) RARBRAB9AMAPTSMN1; SMN2KDM4E

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-0387315-B1 FLUORINATED ALKOXYL COMPOUNDS MERCK PATENT GMBH (DE) 1993-12-08 — — EP disclosed
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