SCHEMBL11590186

SCHEMBL11590186

O=C(Nc1cccc(C(=O)O)c1C(=O)O)c1ccc(Cl)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SUCNR1 Q9BXA5 1/20 0.58
▸ KMT2A Q03164 6/20 0.56
▸ NPC1 O15118 5/20 0.56
▸ RAB9A P51151 5/20 0.56
▸ MEN1 O00255 5/20 0.56
▸ TP53 P04637 3/20 0.56
▸ MDM4 O15151 1/20 0.55
▸ MDM2 Q00987 1/20 0.55
▸ DHODH Q02127 1/20 0.55
▸ SERPINE1 P05121 3/20 0.55
▸ NR4A1 P22736 1/20 0.53
▸ PKM P14618 1/20 0.53
▸ RXFP1 Q9HBX9 1/20 0.51
▸ L3MBTL1 Q9Y468 2/20 0.51
▸ AKR1C4 P17516 1/20 0.51
▸ AKR1C3 P42330 1/20 0.51
▸ AKR1C2 P52895 1/20 0.51
▸ AKR1C1 Q04828 1/20 0.51
▸ GAA P10253 1/20 0.51
▸ KDR P35968 1/20 0.51

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
SCHEMBL7832216 0.87 MEN1 (0.68) SUCNR1KMT2ANPC1RAB9AMEN1
SCHEMBL16583930 0.86 DHODH (0.73) SUCNR1KMT2ANPC1RAB9AMEN1
SCHEMBL11594686 0.85 NPC1 (0.63) KMT2ANPC1RAB9AMEN1DHODH
SCHEMBL6240737 0.84 MEN1 (0.68) SUCNR1KMT2ANPC1RAB9AMEN1
SCHEMBL11592326 0.81 F10 (0.66) KMT2ANPC1RAB9AMEN1PKM
SCHEMBL6848585 0.80 NPC1 (0.54) KMT2ANPC1RAB9AMEN1TP53
SCHEMBL11594362 0.80 CYP1A2 (0.68) KMT2ANPC1RAB9AMEN1KDR
SCHEMBL6847188 0.79 NPC1 (0.53) KMT2ANPC1RAB9AMEN1DHODH
SCHEMBL2293960 0.78 SERPINE1 (0.76) SUCNR1KMT2ANPC1RAB9AMEN1
SCHEMBL9767724 0.78 KMT2A (0.79) KMT2ANPC1RAB9AMEN1TP53

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
US-4088651-A Acylamino quinophthalone compounds BAYER AKTIENGESELLSCHAFT (DT) 1978-05-09 — — US disclosed
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