SCHEMBL11244555

SCHEMBL11244555

CCN(CC)c1ccc(C2(Nc3ccccc3-c3ccc(OC(C)C)cc3)OC(=O)c3cccnc32)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 1/20 0.36
FFAR4 Q5NUL3 1/20 0.34
MAPT P10636 4/20 0.33
TP53 P04637 1/20 0.33
GHSR Q92847 2/20 0.33
KDM4E B2RXH2 2/20 0.32
GPR88 Q9GZN0 1/20 0.31
EGLN1 Q9GZT9 1/20 0.31
KIT P10721 1/20 0.31
PDGFRA P16234 1/20 0.31
KDR P35968 1/20 0.31
MEN1 O00255 1/20 0.31
NPC1 O15118 1/20 0.31
ALDH1A1 P00352 1/20 0.31
THRB P10828 1/20 0.31
HPGD P15428 1/20 0.31
MAPK1 P28482 1/20 0.31
HTT P42858 1/20 0.31
RAB9A P51151 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL11241799 0.92 CNR2 (0.36) CNR2MAPTTP53GHSRKDM4E
SCHEMBL11235699 0.81 MAPT (0.34) CNR2FFAR4MAPTTP53GHSR
SCHEMBL11244546 0.80 CNR2 (0.41) CNR2FFAR4MAPTTP53GHSR
SCHEMBL11440071 0.79 RPS6KA2 (0.37) CNR2MAPTTP53MEN1ALDH1A1
SCHEMBL11365556 0.77 ALDH1A1 (0.37) MAPTTP53KDM4EMEN1NPC1
SCHEMBL11240846 0.70 MAPT (0.36) MAPTTP53GHSRKDM4EALDH1A1
SCHEMBL11241792 0.70 CNR2 (0.41) CNR2MAPTTP53GHSRGPR88
SCHEMBL8064633 0.70 ALDH1A1 (0.40) MAPTTP53GHSRKDM4EMEN1
SCHEMBL11377390 0.70 CYP3A4 (0.44) MAPTTP53NPC1ALDH1A1MAPK1
SCHEMBL11367714 0.69 MAPT (0.39) CNR2MAPTGHSRKDM4EKIT

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4337340-A FROM DIPHENYLAMINES AND BENZOYL OR 3-INDOLYLCARBONYL PYRIDINE- OR PYRAZINECARBOXYLIC ACIDS STERLING DRUG INC. (US) 1982-06-29 US disclosed
US-4243250-A FUROPYRIDINONES OR FUROPYRAZINONES AS COLOR FORMERS STERLING DRUG INC. (US) 1981-01-06 US disclosed
US-4211872-A COLOR FORMERS FREEDOM CHEMICAL COMPANY 1980-07-08 US disclosed