SCHEMBL7466732

SCHEMBL7466732

[CH2]Cc1ccccc1NC(=O)NC

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.66
SMN1; SMN2 Q16637 2/20 0.66
RECQL P46063 1/20 0.66
L3MBTL1 Q9Y468 1/20 0.49
POLB P06746 4/20 0.47
TAS1R3 Q7RTX0 1/20 0.46
TAS1R1 Q7RTX1 1/20 0.46
HTT P42858 1/20 0.46
KMT2A Q03164 4/20 0.45
MEN1 O00255 3/20 0.45
GAA P10253 1/20 0.45
MAPT P10636 2/20 0.44
PKM P14618 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
HDAC3 O15379 1/20 0.41
HDAC4 P56524 1/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC7 Q8WUI4 1/20 0.41
HDAC2 Q92769 1/20 0.41
HDAC10 Q969S8 1/20 0.41

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
SCHEMBL840362 0.81 ALDH1A1 (0.55) ALDH1A1SMN1; SMN2L3MBTL1POLBHTT
SCHEMBL13329758 0.81 ALDH1A1 (0.63) ALDH1A1SMN1; SMN2RECQLL3MBTL1POLB
SCHEMBL21504754 0.81 L3MBTL1 (0.73) ALDH1A1SMN1; SMN2RECQLL3MBTL1POLB
SCHEMBL14003501 0.80 ALDH1A1 (1.00) ALDH1A1SMN1; SMN2RECQLPOLBHTT
SCHEMBL27401813 0.79 GAA (0.48) ALDH1A1SMN1; SMN2RECQLL3MBTL1POLB
SCHEMBL8927399 0.76 ALDH1A1 (0.73) ALDH1A1SMN1; SMN2RECQLPOLBHTT
SCHEMBL8902669 0.75 KCNK3 (0.57) SMN1; SMN2POLBKMT2AMEN1MAPT
SCHEMBL9717979 0.75 HTT (0.72) ALDH1A1SMN1; SMN2POLBTAS1R3TAS1R1
SCHEMBL29580443 0.75 HTT (0.72) ALDH1A1SMN1; SMN2POLBTAS1R3TAS1R1
SCHEMBL28416832 0.75 ALDH1A1 (0.87) ALDH1A1SMN1; SMN2RECQLPOLBHTT

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 6 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
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