SCHEMBL21247216

SCHEMBL21247216

Cc1n[nH]cc1C(=O)Nc1sc2c(c1C(=O)O)CCC(C)(C)C2

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FABP4 P15090 4/20 0.48
▸ FABP5 Q01469 4/20 0.48
▸ PDE4B Q07343 1/20 0.48
▸ PDE4D Q08499 1/20 0.48
▸ MEN1 O00255 5/20 0.47
▸ KMT2A Q03164 5/20 0.47
▸ RAB7A P51149 1/20 0.46
▸ KIF11 P52732 1/20 0.43
▸ RORC P51449 1/20 0.43
▸ NPC1 O15118 3/20 0.43
▸ RAB9A P51151 3/20 0.43
▸ LMNA P02545 2/20 0.43
▸ MAPT P10636 2/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ TNF P01375 1/20 0.41
▸ NOD1 Q9Y239 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ TP53 P04637 1/20 0.41
▸ HPGD P15428 1/20 0.41

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
SCHEMBL21247292 0.93 RAB7A (0.54) FABP4FABP5PDE4BPDE4DMEN1
SCHEMBL21247303 0.80 PTPN1 (0.59) MEN1KMT2ARAB7ANPC1RAB9A
SCHEMBL21247392 0.77 RAB7A (0.68) PDE4BPDE4DMEN1KMT2ARAB7A
SCHEMBL21247104 0.76 MEN1 (0.54) FABP4FABP5PDE4BPDE4DMEN1
SCHEMBL21261022 0.75 FLT3 (0.58) FABP4FABP5PDE4BPDE4DMEN1
SCHEMBL22680862 0.75 MEN1 (0.69) PDE4BPDE4DMEN1KMT2ARAB7A
SCHEMBL21261092 0.74 GLO1 (0.72) MEN1KMT2ARAB7ANPC1RAB9A
SCHEMBL21247339 0.74 MEN1 (0.69) PDE4BPDE4DMEN1KMT2ARAB7A
SCHEMBL21261056 0.74 RAB7A (0.48) FABP4FABP5PDE4BPDE4DMEN1
SCHEMBL21260928 0.73 RAB7A (0.47) FABP4FABP5PDE4BPDE4DRAB7A

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
EP-3749659-A1 FUSED THIOPHENE DERIVATIVES AND THEIR USES ENYO Pharma (FR) 2020-12-16 — — EP disclosed
WO-2019154950-A1 FUSED THIOPHENE DERIVATIVES AND THEIR USES ENYO PHARMA (FR) 2019-08-15 — — WO disclosed
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