SCHEMBL7477649

SCHEMBL7477649

[CH2]Cc1cccc(NC(=O)NC)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SAE1 Q9UBE0 1/20 0.50
UBA2 Q9UBT2 1/20 0.50
SMN1; SMN2 Q16637 6/20 0.48
MAPT P10636 5/20 0.48
MEN1 O00255 4/20 0.48
KMT2A Q03164 4/20 0.48
RAB9A P51151 3/20 0.48
NPC1 O15118 2/20 0.48
GAA P10253 1/20 0.48
ALOX15 P16050 1/20 0.48
HPSE Q9Y251 1/20 0.46
ALDH1A1 P00352 3/20 0.44
DDX3X O00571 1/20 0.44
LMNA P02545 1/20 0.44
HTT P42858 1/20 0.44
RECQL P46063 1/20 0.44
MGLL Q99685 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
HDAC3 O15379 1/20 0.43
HDAC4 P56524 1/20 0.43

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
SCHEMBL19445374 0.86 PDK1 (0.56) SAE1UBA2SMN1; SMN2MAPTMEN1
SCHEMBL14405803 0.86 MAPT (0.62) SAE1UBA2SMN1; SMN2MAPTMEN1
SCHEMBL4599285 0.85 CFD (0.51) SAE1UBA2SMN1; SMN2MAPTMEN1
SCHEMBL11509820 0.83 HPSE (0.50) SAE1UBA2SMN1; SMN2MAPTMEN1
SCHEMBL11629452 0.83 SELP (0.50) SAE1UBA2SMN1; SMN2MAPTMEN1
SCHEMBL13853875 0.83 MAPT (0.61) SMN1; SMN2MAPTMEN1KMT2ARAB9A
SCHEMBL11628807 0.83 HPSE (0.65) SAE1UBA2SMN1; SMN2MAPTMEN1
SCHEMBL840217 0.82 ALDH1A1 (0.59) SMN1; SMN2MAPTMEN1KMT2ARAB9A
SCHEMBL11508504 0.82 NOS3 (0.52) SAE1UBA2SMN1; SMN2MAPTMEN1
Hydrochloric Acid SCHEMBL11628069 0.82 HPSE (0.63) SAE1UBA2SMN1; SMN2MAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0650476-B1 PERIPHERAL VASODILATING AGENT CONTAINING N-ACYLATED 4-AMINO PIPERIDINE DERIVATIVES AS ACTIVE INGREDIENTS OTSUKA PHARMA CO LTD (JP) 2002-06-26 EP disclosed
US-6136826-A AMINOPIPERIDINE COMPOUNDS SUBSTITUTED WITH ALKANOYL OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2000-10-24 US disclosed
CN-1052224-C Peripheral Vasodilating agent containing N-acylated 4-amino piperidine derivatives as active ingredients OTSUKA PHARMA CO LTD (JP) 2000-05-10 CN disclosed
US-5760058-A Peripheral vasodilating agent containing piperidine derivative as active ingredient OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1998-06-02 US disclosed
US-5656642-A Peripheral vasodilating agent containing piperidine derivative as active ingredient OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1997-08-12 US disclosed
EP-0650476-A1 PERIPHERAL VASODILATING AGENT CONTAINING N-ACYLATED 4-AMINO PIPERIDINE DERIVATIVES AS ACTIVE INGREDIENTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1995-05-03 EP disclosed
WO-1994022826-A1 PERIPHERAL VASODILATING AGENT CONTAINING N-ACYLATED 4-AMINO PIPERIDINE DERIVATIVES AS ACTIVE INGREDIENTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1994-10-13 WO disclosed