SCHEMBL16223148

SCHEMBL16223148

O=C(O)c1cccc(N2C(=O)N/C(=C\c3ccncc3)C2=O)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 7/20 0.58
▸ RECQL P46063 6/20 0.58
▸ CTDSP1 Q9GZU7 3/20 0.58
▸ PTP4A3 O75365 2/20 0.58
▸ MEN1 O00255 7/20 0.54
▸ KMT2A Q03164 7/20 0.54
▸ POLB P06746 6/20 0.54
▸ PKM P14618 4/20 0.54
▸ MCL1 Q07820 3/20 0.54
▸ KDM4E B2RXH2 3/20 0.54
▸ NSD2 O96028 3/20 0.54
▸ L3MBTL1 Q9Y468 3/20 0.54
▸ CACNA1B Q00975 2/20 0.54
▸ APBA1 Q02410 2/20 0.54
▸ BLM P54132 2/20 0.54
▸ USP2 O75604 2/20 0.54
▸ THRB P10828 1/20 0.54
▸ TNNI3 P19429 1/20 0.54
▸ PTPN7 P35236 1/20 0.54
▸ TNNT2 P45379 1/20 0.54

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
SCHEMBL16229922 0.89 TDP1 (0.47) TDP1RECQLCTDSP1PTP4A3MEN1
SCHEMBL16223222 0.85 RECQL (0.57) TDP1RECQLCTDSP1MEN1KMT2A
SCHEMBL16245678 0.84 POLB (0.45) TDP1RECQLCTDSP1PTP4A3MEN1
SCHEMBL16223359 0.83 MAPT (0.63) TDP1RECQLMEN1KMT2APKM
SCHEMBL16245623 0.83 GAA (0.58) TDP1RECQLCTDSP1PTP4A3MEN1
SCHEMBL16223157 0.82 MEN1 (0.50) TDP1RECQLCTDSP1PTP4A3MEN1
Hydrochloric Acid SCHEMBL16245570 0.82 MAPT (0.61) TDP1RECQLMEN1KMT2APKM
SCHEMBL16223234 0.81 MAPT (0.48) TDP1RECQLMEN1KMT2APOLB
SCHEMBL16223248 0.79 CFTR (0.61) MEN1KMT2APKMMAPTHTT
SCHEMBL16223188 0.77 MAPT (0.55) TDP1MEN1KMT2APOLBPKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2801573-A1 Hydantoine derivatives as CD38 inhibitors SANOFI (FR) 2014-11-12 — — EP claimed
WO-2014180544-A1 HYDANTOINE DERIVATIVES AS CD38 INHIBITORS SANOFI (FR) 2014-11-13 — — WO disclosed
WO-2014180544-A1 HYDANTOINE DERIVATIVES AS CD38 INHIBITORS SANOFI (FR) 2014-11-13 — — WO disclosed
EP-2801573-A1 Hydantoine derivatives as CD38 inhibitors SANOFI (FR) 2014-11-12 — — EP disclosed
EP-2801573-A1 Hydantoine derivatives as CD38 inhibitors SANOFI (FR) 2014-11-12 — — EP disclosed
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