SCHEMBL9204597

SCHEMBL9204597

[O]Cc1nnnn1C1CCCCC1

nearest known ligand 0.63

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.63
MAPT P10636 3/20 0.63
TP53 P04637 1/20 0.63
TSHR P16473 2/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
HDAC1 Q13547 1/20 0.47
HDAC6 Q9UBN7 1/20 0.47
NPSR1 Q6W5P4 1/20 0.46
ALOX15 P16050 1/20 0.45
CASP1 P29466 1/20 0.45
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
USP2 O75604 1/20 0.43
NPBWR1 P48145 1/20 0.43
MCHR1 Q99705 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
SCHEMBL8888873 0.98 ALDH1A1 (0.60) ALDH1A1MAPTTP53TSHRSMN1; SMN2
SCHEMBL9204714 0.86 ALDH1A1 (0.59) ALDH1A1MAPTTP53TSHRSMN1; SMN2
SCHEMBL3091610 0.81 ALDH1A1 (0.63) ALDH1A1MAPTTP53TSHRSMN1; SMN2
SCHEMBL9204606 0.81 ALDH1A1 (0.63) ALDH1A1MAPTTP53TSHRSMN1; SMN2
SCHEMBL15014082 0.81 ALDH1A1 (0.63) ALDH1A1MAPTTP53TSHRSMN1; SMN2
SCHEMBL25218201 0.81 ALDH1A1 (0.63) ALDH1A1MAPTTP53TSHRSMN1; SMN2
SCHEMBL3300574 0.80 L3MBTL1 (0.58) ALDH1A1MAPTTP53TSHRSMN1; SMN2
SCHEMBL7311249 0.80 ALDH1A1 (0.56) ALDH1A1MAPTTP53TSHRSMN1; SMN2
SCHEMBL8888879 0.79 ALDH1A1 (0.60) ALDH1A1MAPTTP53TSHRSMN1; SMN2
SCHEMBL13181154 0.79 ALDH1A1 (0.59) ALDH1A1MAPTTP53TSHRSMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0489877-B1 ANTIATHEROSCLEROTIC AND ANTITHROMBOTIC 2-AMINO-6-PHENYL-4H-PYRAN-4-ONES UPJOHN CO (US) 1995-09-20 EP disclosed