SCHEMBL1669586

SCHEMBL1669586

O=C1S/C(=C\c2cc(Br)cc(Br)c2)C(=O)N1Cc1ccccc1CF

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PIM1 P11309 1/20 0.56
▸ PPARG P37231 2/20 0.53
▸ ALDH1A1 P00352 2/20 0.47
▸ DVL1 O14640 1/20 0.43
▸ ENPP2 Q13822 5/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ PTPN1 P18031 1/20 0.42
▸ ACP1 P24666 1/20 0.42
▸ MAOA P21397 1/20 0.42
▸ MAOB P27338 1/20 0.42
▸ AKR1B1 P15121 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
SCHEMBL1613781 0.85 PIM1 (0.53) PIM1PPARGALDH1A1DVL1ENPP2
SCHEMBL1614757 0.83 ENPP2 (0.61) PPARGALDH1A1ENPP2MEN1KMT2A
SCHEMBL1612918 0.73 PPARG (0.50) PIM1PPARGALDH1A1ENPP2MEN1
SCHEMBL1614334 0.73 ENPP2 (0.54) PIM1PPARGALDH1A1ENPP2MEN1
SCHEMBL1614287 0.72 MCL1 (0.47) PPARGALDH1A1MEN1KMT2AMAOA
SCHEMBL2548401 0.72 PIM1 (1.00) PIM1PPARGALDH1A1ENPP2MEN1
SCHEMBL2548399 0.72 PIM1 (1.00) PIM1PPARGALDH1A1ENPP2MEN1
SCHEMBL1613879 0.70 SLC2A1 (0.57) PPARGALDH1A1MEN1KMT2AMAOA
SCHEMBL5462147 0.69 MEN1 (0.58) ALDH1A1ENPP2MEN1KMT2APTPN1
SCHEMBL5462143 0.69 MEN1 (0.58) ALDH1A1ENPP2MEN1KMT2APTPN1

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-2488027-A1 THIAZOLIDINEDIONE ENERGY RESTRICTION-MIMETIC AGENTS The Ohio State University Research Foundation (US) 2012-08-22 — — EP disclosed
WO-2011044548-A1 THIAZOLIDINEDIONE ENERGY RESTRICTION-MIMETIC AGENTS THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) 2011-04-14 — — WO disclosed
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