SCHEMBL5014136

SCHEMBL5014136

Cc1ccc(C(=O)O[C@H]2CC[C@H](N)CC2)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SCN1A P35498 2/20 0.65
▸ SCN2A Q99250 2/20 0.65
▸ SCN3A Q9NY46 2/20 0.65
▸ F2 P00734 1/20 0.52
▸ PRSS1 P07477 1/20 0.52
▸ PRSS2 P07478 1/20 0.52
▸ PRSS3 P35030 1/20 0.52
▸ ST14 Q9Y5Y6 1/20 0.52
▸ MAPT P10636 3/20 0.50
▸ ALDH1A1 P00352 1/20 0.50
▸ TDP1 Q9NUW8 1/20 0.47
▸ STS P08842 4/20 0.47
▸ MEN1 O00255 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ SERPINE1 P05121 1/20 0.45
▸ SMN1; SMN2 Q16637 3/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ HTT P42858 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ LMNA P02545 1/20 0.42

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
SCHEMBL5014135 1.00 SCN1A (0.65) SCN1ASCN2ASCN3AF2PRSS1
SCHEMBL27947110 0.91 SCN1A (0.75) SCN1ASCN2ASCN3AMAPTALDH1A1
SCHEMBL4544916 0.91 SCN1A (0.75) SCN1ASCN2ASCN3AMAPTALDH1A1
SCHEMBL9891376 0.91 SCN1A (0.75) SCN1ASCN2ASCN3AMAPTALDH1A1
Trifluoroacetic Acid SCHEMBL2975912 0.90 SCN1A (0.55) SCN1ASCN2ASCN3AF2PRSS1
Trifluoroacetic Acid SCHEMBL2975916 0.90 SCN1A (0.55) SCN1ASCN2ASCN3AF2PRSS1
Methane SCHEMBL9812755 0.90 F2 (0.57) SCN1ASCN2ASCN3AF2PRSS1
Propane SCHEMBL10482243 0.88 F2 (0.53) SCN1ASCN2ASCN3AF2PRSS1
SCHEMBL25113180 0.86 SCN1A (0.69) SCN1ASCN2ASCN3AMAPTALDH1A1
SCHEMBL13038153 0.85 SCN1A (0.67) SCN1ASCN2ASCN3AMAPTALDH1A1

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-1884510-A1 N-SUBSTITUTED PHENYLACETAMIDE DERIVATIVE AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME Dainippon Sumitomo Pharma Co., Ltd. (JP) 2008-02-06 — — EP disclosed
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