SCHEMBL8415552

SCHEMBL8415552

CCOC(=O)[C@H](C)N(C(=O)Cc1ccccc1)c1c(C)cccc1C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RORC P51449 1/20 0.50
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
PLA2G1B P04054 1/20 0.49
HTT P42858 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
ATG4B Q9Y4P1 1/20 0.49
TRPM8 Q7Z2W7 1/20 0.49
SMN1; SMN2 Q16637 2/20 0.46
MMP8 P22894 1/20 0.45
NPC1 O15118 1/20 0.42
LMNA P02545 3/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
TSHR P16473 1/20 0.42
POLB P06746 2/20 0.42
ALDH1A1 P00352 1/20 0.42
HSD17B10 Q99714 1/20 0.42
PIN1 Q13526 1/20 0.40
CNR2 P34972 1/20 0.40
TP53 P04637 1/20 0.39

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
SCHEMBL11108635 1.00 RORC (0.50) RORCMEN1KMT2APLA2G1BHTT
SCHEMBL11213091 0.91 MEN1 (0.46) RORCMEN1KMT2APLA2G1BHTT
Benalaxyl SCHEMBL2528870 0.90 KMT2A (0.61) RORCMEN1KMT2APLA2G1BHTT
Benalaxyl SCHEMBL54808 0.90 KMT2A (0.61) RORCMEN1KMT2APLA2G1BHTT
Benalaxyl SCHEMBL8818251 0.90 KMT2A (0.61) RORCMEN1KMT2APLA2G1BHTT
Benalaxyl SCHEMBL41642 0.90 KMT2A (0.61) RORCMEN1KMT2APLA2G1BHTT
Benalaxyl SCHEMBL21674 0.90 KMT2A (0.61) RORCMEN1KMT2APLA2G1BHTT
Benalaxyl SCHEMBL7182610 0.89 KMT2A (0.60) RORCMEN1KMT2APLA2G1BHTT
Benalaxyl SCHEMBL27822944 0.89 KMT2A (0.60) RORCMEN1KMT2APLA2G1BHTT
SCHEMBL6206675 0.87 TRPM8 (0.52) MEN1KMT2APLA2G1BHTTNPSR1

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
EP-0934258-A1 PHENYLCARBAMATES, METHODS FOR PREPARING THEM AND AGENTS CONTAINING THEM BASF AKTIENGESELLSCHAFT (DE) 1999-08-11 EP disclosed
WO-1997043252-A1 PHENYLCARBAMATES, METHODS FOR PREPARING THEM AND AGENTS CONTAINING THEM BASF AKTIENGESELLSCHAFT (DE) 1997-11-20 WO disclosed