SCHEMBL10743173

SCHEMBL10743173

C[C@H](NC(=O)OC(C)(C)C)C(=O)Nc1c(C(=O)CC(=O)Nc2nccs2)cccc1C(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ METAP1 P53582 1/20 0.41
▸ HSPA5 P11021 6/20 0.40
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ HSPA2 P54652 3/20 0.39
▸ HTT P42858 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ HSPA9 P38646 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ HPGD P15428 1/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ PKM P14618 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.37

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
SCHEMBL10743968 0.92 HTT (0.47) METAP1HSPA5HSPA2HTTSMN1; SMN2
SCHEMBL10744566 0.90 HSPA5 (0.49) METAP1HSPA5MEN1KMT2AHSPA2
SCHEMBL10739363 0.88 METAP1 (0.43) METAP1MEN1KMT2ASMN1; SMN2HPGD
SCHEMBL10740057 0.87 HSPA5 (0.51) HSPA5MEN1KMT2AHSPA2HSPA9
SCHEMBL10738767 0.85 CTSS (0.46) HSPA5MEN1KMT2AHSPA2HSPA9
SCHEMBL10944127 0.83 MEN1 (0.41) HSPA5MEN1KMT2ASMN1; SMN2HPGD
SCHEMBL10660799 0.83 HSPA5 (0.43) HSPA5MEN1KMT2AHSPA2HTT
SCHEMBL10731537 0.83 HTT (0.42) HSPA5MEN1KMT2AHSPA2HTT
SCHEMBL10730705 0.83 HSPA5 (0.43) HSPA5MEN1KMT2AHSPA2HTT
SCHEMBL10737795 0.82 MEN1 (0.42) HSPA5MEN1KMT2ASMN1; SMN2HPGD

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
US-4636512-A Anti-inflammatory 2-substituted-4-hydroxy-3-quinoline carboxamides ROUSSEL UCLAF (FR) 1987-01-13 — — US disclosed
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