SCHEMBL10496201

SCHEMBL10496201

NC(=O)C1=Cc2cccc3cccc1c23

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 5/20 0.49
▸ KMT2A Q03164 5/20 0.49
▸ MAPT P10636 4/20 0.49
▸ MAPK1 P28482 3/20 0.49
▸ ALDH1A1 P00352 7/20 0.42
▸ CES2 O00748 1/20 0.42
▸ BCHE P06276 1/20 0.42
▸ CES1 P23141 1/20 0.42
▸ MCL1 Q07820 1/20 0.42
▸ HSD17B10 Q99714 6/20 0.40
▸ S100A4 P26447 1/20 0.40
▸ KDM4E B2RXH2 4/20 0.38
▸ RXFP1 Q9HBX9 2/20 0.38
▸ PABPC1 P11940 2/20 0.38
▸ HTT P42858 2/20 0.38
▸ ALOX15 P16050 2/20 0.38
▸ USP2 O75604 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ MPI P34949 1/20 0.38
▸ CACNA1B Q00975 1/20 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
SCHEMBL9240057 0.85 MEN1 (0.52) MEN1KMT2AMAPTMAPK1ALDH1A1
SCHEMBL1252690 0.83 MEN1 (0.50) MEN1KMT2AMAPTMAPK1ALDH1A1
SCHEMBL17183627 0.83 MEN1 (0.44) MEN1KMT2AMAPTMAPK1ALDH1A1
SCHEMBL5372658 0.81 MEN1 (0.49) MEN1KMT2AMAPTMAPK1ALDH1A1
SCHEMBL546951 0.80 MEN1 (0.47) MEN1KMT2AMAPTMAPK1ALDH1A1
SCHEMBL28822328 0.79 MEN1 (0.46) MEN1KMT2AMAPTMAPK1ALDH1A1
SCHEMBL28767639 0.77 KMT2A (0.45) MEN1KMT2AMAPTMAPK1ALDH1A1
SCHEMBL23300514 0.76 MAPT (0.44) MEN1KMT2AMAPTMAPK1ALDH1A1
SCHEMBL3129414 0.75 MEN1 (0.46) MEN1KMT2AMAPTMAPK1ALDH1A1
SCHEMBL20240548 0.75 MAOA (0.40) MEN1KMT2AMAPTALDH1A1CES2

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
US-4859697-A Substituted acenaphthenes and their use as inhibitors of phospholipase A2 E. I. DU PONT DE NEMOURS AND COMPANY (US) 1989-08-22 — — US disclosed
US-4806671-A Substituted acenaphthenes and their use as inhibitors of phospholipase A2 E. I. DU PONT DE NEMOURS AND COMPANY (US) 1989-02-21 — — US disclosed
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