SCHEMBL7328464

SCHEMBL7328464

O=C1C/C(=C/c2cccc3ccccc23)C(=O)O1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.49
MAPT P10636 2/20 0.49
HTT P42858 2/20 0.49
LMNA P02545 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
ACHE P22303 1/20 0.47
KMT2A Q03164 3/20 0.47
MEN1 O00255 2/20 0.47
AKR1B1 P15121 2/20 0.47
TTR P02766 1/20 0.47
PIM1 P11309 1/20 0.44
SIRT1 Q96EB6 2/20 0.44
SIRT2 Q8IXJ6 1/20 0.44
APP P05067 1/20 0.41
GLA P06280 2/20 0.40
POLB P06746 1/20 0.40
RXRA P19793 1/20 0.38
PKM P14618 1/20 0.37
KDM4E B2RXH2 2/20 0.37

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
SCHEMBL9740855 1.00 ALDH1A1 (0.49) ALDH1A1MAPTHTTLMNASMN1; SMN2
SCHEMBL7328466 1.00 ALDH1A1 (0.49) ALDH1A1MAPTHTTLMNASMN1; SMN2
SCHEMBL7273033 0.86 ALDH1A1 (0.51) ALDH1A1MAPTHTTLMNASMN1; SMN2
SCHEMBL9046126 0.77 IKBKB (0.58) ALDH1A1MAPTACHENPC1RAB9A
SCHEMBL9047619 0.77 KDM4E (0.51) ALDH1A1MAPTSMN1; SMN2ACHEKMT2A
SCHEMBL9047611 0.77 KDM4E (0.51) ALDH1A1MAPTSMN1; SMN2ACHEKMT2A
SCHEMBL9047790 0.77 DYRK2 (0.56) ALDH1A1MAPTHTTNPSR1ACHE
SCHEMBL9047786 0.77 DYRK2 (0.56) ALDH1A1MAPTHTTNPSR1ACHE
SCHEMBL9046118 0.77 IKBKB (0.58) ALDH1A1MAPTACHENPC1RAB9A
SCHEMBL7170445 0.76 ALDH1A1 (0.66) ALDH1A1MAPTHTTLMNASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0396065-A1 Novel amino acid derivatives possessing renin-inhibitory activities Japan Tobacco Inc. (JP) 1990-11-07 EP disclosed
US-4863904-A Dipeptides as renin inhibitors KISSEI PHARMACEUTICAL CO., LTD. (JP) 1989-09-05 US disclosed
US-4857650-A Novel renin inhibitory amino acid derivatives KISSEI PHARMACEUTICAL CO., LTD. (JP) 1989-08-15 US disclosed
US-4853463-A Amino acid derivatives KISSEI PHARMACEUTICAL CO., LTD. (JP) 1989-08-01 US disclosed
US-4841067-A RENIN INHIBITORS KISSEI PHARMACEUTICAL CO., LTD. (JP) 1989-06-20 US disclosed
US-4711958-A HYPOTENSIVE AGENTS KISSEI PHARMACEUTICAL CO., LTD. (JP) 1987-12-08 US disclosed
EP-0244083-A2 Amino acid derivatives Kissei Pharmaceutical Co. Ltd. (JP) 1987-11-04 EP disclosed
US-4656269-A RENIN INHIBITORY EFFECT WHEN ADMINISTERING ORALLY; HYPOTENSIVE AGENTS KISSEI PHARMACEUTICAL CO., LTD. (JP) 1987-04-07 US disclosed
EP-0216539-A2 Novel amino acid derivatives Kissei Pharmaceutical Co. Ltd. (JP) 1987-04-01 EP disclosed
EP-0206807-A2 Novel amino acid derivatives Kissei Pharmaceutical Co. Ltd. (JP) 1986-12-30 EP disclosed
EP-0200406-A2 Novel amino acid derivatives Kissei Pharmaceutical Co. Ltd. (JP) 1986-11-05 EP disclosed
EP-0190891-A2 Novel amino acid derivatives Kissei Pharmaceutical Co. Ltd. (JP) 1986-08-13 EP disclosed
EP-0181110-A2 Histidine derivatives as renin inhibitors Kissei Pharmaceutical Co. Ltd. (JP) 1986-05-14 EP disclosed