SCHEMBL11035491

SCHEMBL11035491

Cc1ccc(OCN2CCCC2=O)cc1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.54
TP53 P04637 1/20 0.54
ALDH1A1 P00352 5/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
KMT2A Q03164 2/20 0.50
MEN1 O00255 1/20 0.50
ACACB O00763 1/20 0.50
HTT P42858 2/20 0.47
POLB P06746 1/20 0.47
CYP2C19 P33261 1/20 0.46
SMN1; SMN2 Q16637 3/20 0.45
PKM P14618 2/20 0.45
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
HSD17B10 Q99714 1/20 0.43
PIK3CD O00329 1/20 0.42
MAPK1 P28482 2/20 0.41
TSHR P16473 1/20 0.40
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL13946706 0.84 POLB (0.56) LMNATP53ALDH1A1L3MBTL1KMT2A
SCHEMBL8469734 0.83 POLB (0.51) ALDH1A1L3MBTL1KMT2AMEN1ACACB
SCHEMBL7820778 0.81 ALDH1A1 (0.48) LMNAALDH1A1L3MBTL1KMT2AMEN1
Hydrochloric Acid SCHEMBL5443083 0.78 L3MBTL1 (0.52) L3MBTL1KMT2AMEN1ACACBNPC1
SCHEMBL20201606 0.77 NPY4R (0.42) LMNATP53ALDH1A1L3MBTL1KMT2A
SCHEMBL13215733 0.75 L3MBTL1 (0.65) LMNATP53ALDH1A1L3MBTL1KMT2A
SCHEMBL9662234 0.73 ALOX12 (0.38) LMNATP53ALDH1A1L3MBTL1KMT2A
SCHEMBL7496243 0.73 POLB (0.51) POLBNPC1RAB9A
SCHEMBL13946703 0.72 HRH3 (0.54) ALDH1A1L3MBTL1KMT2AMEN1CYP2C19
SCHEMBL12947867 0.71 L3MBTL1 (0.70) LMNATP53L3MBTL1KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4556674-A ANTICOAGULANTS, ANTIARRHYTHMIA AGENTS LABORATOIRES JACQUES LOGEAIS (FR) 1985-12-03 US disclosed