SCHEMBL7513087

SCHEMBL7513087

O=C1C2=CCCCC2C(=O)N1c1ccccc1O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.36
▸ MAPT P10636 2/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ L3MBTL1 Q9Y468 2/20 0.36
▸ HTT P42858 2/20 0.36
▸ TLR9 Q9NR96 1/20 0.36
▸ GAA P10253 5/20 0.34
▸ KDM4E B2RXH2 3/20 0.34
▸ XBP1 P17861 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ HDAC4 P56524 1/20 0.31
▸ HDAC2 Q92769 1/20 0.31
▸ HDAC8 Q9BY41 1/20 0.31
▸ BRD4 O60885 1/20 0.31
▸ ALDH1A1 P00352 3/20 0.30
▸ HTR1A P08908 1/20 0.30
▸ ADRA1D P25100 1/20 0.30
▸ CYP1A2 P05177 1/20 0.30
▸ CYP2C9 P11712 1/20 0.30

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
SCHEMBL11868086 0.83 — —
SCHEMBL11325543 0.82 GAA (0.40) KMT2AMEN1L3MBTL1TLR9GAA
SCHEMBL4541828 0.80 KMT2A (0.44) KMT2AMAPTMEN1GAAKDM4E
SCHEMBL3459048 0.76 GAA (0.39) KMT2AMAPTMEN1L3MBTL1HTT
SCHEMBL5382589 0.75 PPOX (0.39) NPC1HPGDRAB9A
SCHEMBL8163466 0.73 — —
SCHEMBL11857610 0.73 HSD17B10 (0.41) KMT2AMAPTMEN1POLBALDH1A1
SCHEMBL7145464 0.71 — —
SCHEMBL4763056 0.70 FPR1 (0.38) KMT2AMAPTMEN1KDM4EMAPK1
SCHEMBL10339323 0.69 — —

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-1030843-A4 SUBSTITUTED BENZENE COMPOUNDS, PROCESS FOR THEIR PREPARATION, AND HERBICIDAL AND DEFOLIANT COMPOSITIONS CONTAINING THEM ISK AMERICAS INC (US) 2002-11-06 — — EP disclosed
EP-1030843-A1 SUBSTITUTED BENZENE COMPOUNDS, PROCESS FOR THEIR PREPARATION, AND HERBICIDAL AND DEFOLIANT COMPOSITIONS CONTAINING THEM ISK Americas Incorporated (US) 2000-08-30 — — EP disclosed
WO-1999021837-A1 SUBSTITUTED BENZENE COMPOUNDS, PROCESS FOR THEIR PREPARATION, AND HERBICIDAL AND DEFOLIANT COMPOSITIONS CONTAINING THEM ISK AMERICAS INCORPORATED (US) 1999-05-06 — — WO disclosed
US-3966726-A Process for the production of cyclic carboxylic acid imides AKZO N.V. (NL) 1976-06-29 — — US disclosed
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