SCHEMBL9345597

SCHEMBL9345597

CCOP(=O)(Cc1cc(CC(N)C(=O)O)cc(-c2ccc(Cl)cc2)c1)OCC

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.50
▸ ALOX15 P16050 2/20 0.50
▸ CYP2C19 P33261 2/20 0.50
▸ KMT2A Q03164 2/20 0.50
▸ HSD17B10 Q99714 2/20 0.50
▸ TDP1 Q9NUW8 1/20 0.50
▸ MAPK1 P28482 2/20 0.39
▸ SLC7A5 Q01650 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ PPARG P37231 2/20 0.38
▸ PPARA Q07869 2/20 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
SCHEMBL9345173 0.91 KMT2A (0.40) MEN1ALOX15CYP2C19KMT2AHSD17B10
SCHEMBL9343956 0.90 TDP1 (0.40) MEN1ALOX15CYP2C19KMT2AHSD17B10
SCHEMBL9348521 0.89 MEN1 (0.39) MEN1ALOX15CYP2C19KMT2AHSD17B10
SCHEMBL9344811 0.83 MEN1 (0.69) MEN1ALOX15CYP2C19KMT2AHSD17B10
SCHEMBL9348882 0.82 MEN1 (0.41) MEN1ALOX15CYP2C19KMT2AHSD17B10
SCHEMBL9348888 0.82 MEN1 (0.41) MEN1ALOX15CYP2C19KMT2AHSD17B10
SCHEMBL9344786 0.81 MEN1 (0.43) MEN1ALOX15CYP2C19KMT2AHSD17B10
SCHEMBL9212719 0.79 SLC7A5 (0.53) MEN1ALOX15KMT2AHSD17B10TDP1
SCHEMBL9344824 0.79 PPARA (0.46) ALDH1A1HPGDPPARGPPARA
SCHEMBL9343960 0.75 MEN1 (0.52) MEN1ALOX15CYP2C19KMT2AHSD17B10

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3651758-A1 PROBENECID FOR USE IN TREATING EPILEPTIC DISEASES, DISORDERS OR CONDITIONS Paris Sciences et Lettres - Quartier Latin (FR) 2020-05-20 — — EP disclosed
WO-2019012109-A1 PROBENECID FOR USE IN TREATING EPILEPTIC DISEASES, DISORDERS OR CONDITIONS PARIS SCIENCES ET LETTRES - QUARTIER LATIN (FR) 2019-01-17 — — WO disclosed
US-5321016-A Epliepsy, central nervous system disorders SANDOZ PHARMACEUTICALS CORP. (US) 1994-06-14 — — US disclosed
US-5162311-A Treating epilepsy, psychiatric disorders SANDOZ PHARMACEUTICALS CORP. (US) 1992-11-10 — — US disclosed
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