SCHEMBL9615925

SCHEMBL9615925

CCOC(=O)C(C)N(C=O)c1cc2ccccc2[nH]1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 1/20 0.44
TAS1R1 Q7RTX1 1/20 0.44
KDM4E B2RXH2 7/20 0.42
HPGD P15428 4/20 0.42
ALDH1A1 P00352 3/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
PDGFRB P09619 4/20 0.42
PDGFRA P16234 4/20 0.42
LMNA P02545 2/20 0.41
TP53 P04637 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
GAA P10253 3/20 0.41
KMT2A Q03164 3/20 0.41
TSHR P16473 3/20 0.40
DRD2 P14416 1/20 0.40
MEN1 O00255 2/20 0.40
NPC1 O15118 1/20 0.40
GLA P06280 1/20 0.40
MAPT P10636 1/20 0.40
RAB9A P51151 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
SCHEMBL1464939 0.72 HPGD (0.53) TAS1R3TAS1R1KDM4EHPGDALDH1A1
SCHEMBL10348373 0.72 KDM4E (0.46) KDM4EHPGDALDH1A1SMN1; SMN2PDGFRB
SCHEMBL3672340 0.71 TAS1R3 (0.46) TAS1R3TAS1R1KDM4EHPGDALDH1A1
SCHEMBL28663705 0.69 KDM4E (0.47) KDM4EHPGDALDH1A1SMN1; SMN2LMNA
SCHEMBL19067175 0.68 KDM4E (0.46) KDM4EHPGDALDH1A1SMN1; SMN2LMNA
SCHEMBL29580772 0.67 KDM4E (0.78) KDM4EHPGDALDH1A1SMN1; SMN2PDGFRB
SCHEMBL42002 0.67 KDM4E (0.78) KDM4EHPGDALDH1A1SMN1; SMN2PDGFRB
SCHEMBL88571 0.67 KDM4E (0.40) KDM4EHPGDALDH1A1SMN1; SMN2LMNA
SCHEMBL5260106 0.66 KDM4E (0.48) TAS1R3TAS1R1KDM4EHPGDALDH1A1
SCHEMBL7321937 0.66 MEN1 (0.49) KDM4EHPGDALDH1A1SMN1; SMN2PDGFRB

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
JP-4173786-A None JP disclosed
JP-H04173786-A PRODUCTION OF 4-KETO-TETRAHYDRO-'-CARBOLINE COMPOUND KAWAKEN FINE CHEM CO LTD 1992-06-22 JP disclosed