SCHEMBL8036205

SCHEMBL8036205

CC(C)c1cc2ccccc2c2c1C=CC(C1=CCCN1C)(c1ccc(N3CCOCC3)cc1)O2

nearest known ligand 0.32

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.32
AHR P35869 1/20 0.32
KDM4E B2RXH2 1/20 0.31
NPC1 O15118 1/20 0.31
HCRTR1 O43613 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
GAA P10253 1/20 0.31
RAB9A P51151 1/20 0.31
PIK3C2B O00750 1/20 0.31
ACHE P22303 1/20 0.30
APAF1 O14727 1/20 0.30
CDC25B P30305 1/20 0.30
CASP3 P42574 1/20 0.30
SENP8 Q96LD8 1/20 0.30
SENP7 Q9BQF6 1/20 0.30

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
SCHEMBL7562196 0.89 AHR (0.36) MAPTAHRKDM4ENPC1HCRTR1
SCHEMBL8038479 0.87 AHR (0.38) MAPTAHRKDM4ENPC1HCRTR1
SCHEMBL29756206 0.73 MEN1 (0.32)
SCHEMBL5545747 0.73 MEN1 (0.32)
SCHEMBL8509702 0.72 MEN1 (0.43) MAPTKDM4ENPC1HCRTR1ALDH1A1
SCHEMBL24620642 0.71 LMNA (0.41) MAPTAHRKDM4ENPC1HCRTR1
SCHEMBL10102260 0.71 GPR84 (0.34)
SCHEMBL3824881 0.70 HTT (0.42) MAPTKDM4EALDH1A1LMNAPIK3C2B
SCHEMBL7971543 0.69 KIF11 (0.40) MAPTAHRKDM4ENPC1HCRTR1
SCHEMBL5550214 0.68 KMT2A (0.47) MAPTKDM4EHCRTR1ALDH1A1GAA

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
JP-2000219686-A CHROMENE COMPOUND TOKUYAMA CORP 2000-08-08 JP disclosed