SCHEMBL11083064

SCHEMBL11083064

CN(C)/C=C(/C=O)c1ccc(C(=O)O)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.51
TSHR P16473 3/20 0.46
TP53 P04637 1/20 0.46
ALDH1A1 P00352 4/20 0.45
SMN1; SMN2 Q16637 1/20 0.43
SRD5A2 P31213 3/20 0.41
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
NPC1 O15118 1/20 0.41
CA1 P00915 3/20 0.40
CA2 P00918 3/20 0.40
CA12 O43570 1/20 0.40
CA3 P07451 1/20 0.40
TYR P14679 1/20 0.40
DRD1 P21728 1/20 0.40
CA4 P22748 1/20 0.40
CA6 P23280 1/20 0.40
CA5A P35218 1/20 0.40
CA7 P43166 1/20 0.40
CA9 Q16790 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
SCHEMBL11083067 1.00 POLB (0.51) POLBTSHRTP53ALDH1A1SMN1; SMN2
SCHEMBL10439102 0.84 POLB (0.64) POLBTSHRALDH1A1KMT2AMEN1
SCHEMBL1796055 0.84 POLB (0.64) POLBTSHRALDH1A1KMT2AMEN1
SCHEMBL1796053 0.84 POLB (0.64) POLBTSHRALDH1A1KMT2AMEN1
SCHEMBL11081721 0.83 POLB (0.50) POLBTSHRALDH1A1KMT2ACA1
SCHEMBL11081718 0.83 POLB (0.50) POLBTSHRALDH1A1KMT2ACA1
SCHEMBL11066332 0.82 POLB (0.53) POLBALDH1A1SMN1; SMN2SRD5A2KMT2A
SCHEMBL2805466 0.82 POLB (0.53) POLBTSHRTP53ALDH1A1SMN1; SMN2
SCHEMBL2805463 0.82 POLB (0.53) POLBTSHRTP53ALDH1A1SMN1; SMN2
SCHEMBL11076121 0.82 POLB (0.53) POLBALDH1A1SMN1; SMN2SRD5A2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4465630-A Tetraazaannulene cobalt complex compounds and method for preparation therefor ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1984-08-14 US disclosed
EP-0073456-A1 Tetraazaannulene cobalt complex compounds and method for preparation thereof Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1983-03-09 EP disclosed