SCHEMBL10724596

SCHEMBL10724596

COc1ccc(C(=O)NCC(=O)c2ccco2)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.62
MEN1 O00255 3/20 0.62
ALDH1A1 P00352 6/20 0.59
NPC1 O15118 4/20 0.59
MAPT P10636 3/20 0.57
GAA P10253 3/20 0.57
HTT P42858 2/20 0.57
SMN1; SMN2 Q16637 2/20 0.57
KDM4E B2RXH2 1/20 0.57
HPGD P15428 1/20 0.57
AHR P35869 1/20 0.57
CYP2C9 P11712 1/20 0.57
RECQL P46063 1/20 0.57
RAB9A P51151 3/20 0.54
TSHR P16473 1/20 0.52
L3MBTL1 Q9Y468 2/20 0.52
TNKS O95271 1/20 0.52
PARP1 P09874 1/20 0.52
TNKS2 Q9H2K2 1/20 0.52
POLB P06746 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
SCHEMBL28928844 0.89 ALDH1A1 (0.62) KMT2AMEN1ALDH1A1NPC1MAPT
SCHEMBL10722950 0.85 NPC1 (0.64) KMT2AMEN1ALDH1A1NPC1SMN1; SMN2
SCHEMBL10320585 0.83 ALDH1A1 (0.68) KMT2AMEN1ALDH1A1NPC1MAPT
SCHEMBL10506338 0.83 NPC1 (0.62) KMT2AALDH1A1NPC1GAASMN1; SMN2
SCHEMBL10504806 0.82 KMT2A (0.72) KMT2AMEN1ALDH1A1NPC1MAPT
SCHEMBL10505347 0.82 ALDH1A1 (0.56) KMT2AMEN1ALDH1A1NPC1MAPT
SCHEMBL1193504 0.81 NPC1 (0.65) KMT2AMEN1ALDH1A1NPC1SMN1; SMN2
SCHEMBL15988631 0.80 ALDH1A1 (0.68) KMT2AMEN1ALDH1A1NPC1MAPT
SCHEMBL11336785 0.79 POLB (0.61) ALDH1A1NPC1GAASMN1; SMN2KDM4E
SCHEMBL28972912 0.78 ALDH1A1 (0.62) KMT2AMEN1ALDH1A1NPC1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4642313-A ANTILIPEMIC AGENTS TANABE SEIYAKU CO., LTD. (JP) 1987-02-10 US disclosed
EP-0087782-B1 FURYLOXAZOLYLACETIC ACID DERIVATIVES, PROCESS FOR PREPARING SAME AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME Tanabe Seiyaku Co., Ltd. (JP) 1986-05-21 EP disclosed
EP-0087782-A1 Furyloxazolylacetic acid derivatives, process for preparing same and pharmaceutical compositions containing same Tanabe Seiyaku Co., Ltd. (JP) 1983-09-07 EP disclosed