SCHEMBL7975336

SCHEMBL7975336

COCCOCCOCCOc1cccc(CO)c1C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.44
KMT2A Q03164 3/20 0.44
KDM4E B2RXH2 2/20 0.44
MEN1 O00255 2/20 0.44
SMN1; SMN2 Q16637 3/20 0.41
LMNA P02545 1/20 0.41
POLB P06746 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
PDCD1 Q15116 1/20 0.40
CD274 Q9NZQ7 1/20 0.40
L3MBTL1 Q9Y468 4/20 0.40
PTK2B Q14289 1/20 0.38
MAPT P10636 2/20 0.38
TDP1 Q9NUW8 1/20 0.38
HTR1A P08908 1/20 0.38
HTR1B P28222 1/20 0.37
DRD2 P14416 1/20 0.37
HTR2A P28223 1/20 0.37
HTR7 P34969 1/20 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
SCHEMBL1662732 0.95 PDCD1 (0.43) ALDH1A1KMT2AKDM4EMEN1LMNA
SCHEMBL28481345 0.85 ALDH1A1 (0.47) ALDH1A1KMT2AKDM4EMEN1SMN1; SMN2
SCHEMBL7977434 0.84 L3MBTL1 (0.43) ALDH1A1KDM4ESMN1; SMN2LMNAPOLB
SCHEMBL18090997 0.80 SMN1; SMN2 (0.57) ALDH1A1KMT2AKDM4EMEN1SMN1; SMN2
SCHEMBL3903483 0.80 PDCD1 (0.44) KMT2AMEN1LMNARAB9APDCD1
SCHEMBL16955136 0.80 PDCD1 (0.44) ALDH1A1KDM4EPDCD1CD274L3MBTL1
SCHEMBL19167836 0.80 KDM4E (0.50) ALDH1A1KDM4ESMN1; SMN2LMNAPOLB
SCHEMBL30507629 0.79 KDM4E (0.43) ALDH1A1KMT2AKDM4EMEN1SMN1; SMN2
SCHEMBL1053518 0.79 SMN1; SMN2 (0.43) ALDH1A1KDM4ESMN1; SMN2LMNAL3MBTL1
SCHEMBL7997520 0.79 HTR1B (0.50) KDM4ESMN1; SMN2RAB9APDCD1CD274

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
WO-2001034573-A1 COMPOUNDS ASTRAZENECA AB (SE) 2001-05-17 WO disclosed