SCHEMBL8315587

SCHEMBL8315587

COCOc1ccc(-c2ncccc2C=O)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.43
KDM4E B2RXH2 2/20 0.43
HPGD P15428 1/20 0.43
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
NLRP3 Q96P20 1/20 0.41
CDK4 P11802 1/20 0.39
CDK2 P24941 1/20 0.39
TRIM24 O15164 1/20 0.39
TRIM33 Q9UPN9 1/20 0.39
KCNA5 P22460 1/20 0.37
ERN1 O75460 3/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
CLK4 Q9HAZ1 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
NFE2L2 Q16236 1/20 0.35
FYN P06241 3/20 0.35
LMNA P02545 1/20 0.35
CYP1A2 P05177 1/20 0.35

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
SCHEMBL27530670 0.85 ALDH1A1 (0.59) ALDH1A1KDM4EHPGDMEN1KMT2A
SCHEMBL16096639 0.79 TRIM24 (0.46) ALDH1A1KDM4EHPGDMEN1KMT2A
SCHEMBL7931866 0.78 XDH (0.42) ALDH1A1HPGDMEN1KMT2ANLRP3
SCHEMBL8315584 0.77 KDM4E (0.47) ALDH1A1KDM4EHPGDMEN1KMT2A
SCHEMBL30479918 0.77 TRIM24 (0.47) ALDH1A1KDM4EHPGDMEN1KMT2A
SCHEMBL8318119 0.77 KDM4E (0.49) ALDH1A1KDM4EHPGDMEN1KMT2A
SCHEMBL28022002 0.75 TRPV1 (0.47) ALDH1A1KDM4EHPGDMEN1KMT2A
SCHEMBL29285316 0.75 TRIM24 (0.48) ALDH1A1KDM4EMEN1KMT2ATRIM24
SCHEMBL4650076 0.74 TRIM24 (0.52) ALDH1A1KDM4EHPGDMEN1KMT2A
SCHEMBL4899402 0.74 ERN1 (0.52) ALDH1A1KDM4EHPGDMEN1KMT2A

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-0897920-A1 NOVEL HETEROCYCLIC COMPOUNDS HAVING PLATELET AGGREGATION INHIBITORY EFFECTS MEIJI SEIKA KABUSHIKI KAISHA (JP) 1999-02-24 EP disclosed