SCHEMBL7626074

SCHEMBL7626074

CCC1CC[C](OOC(=O)c2ccc(-c3ccccc3)cc2)CC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 1/20 0.46
SCN1A P35498 1/20 0.44
SCN2A Q99250 1/20 0.44
SCN3A Q9NY46 1/20 0.44
PDCD1 Q15116 1/20 0.42
CD274 Q9NZQ7 1/20 0.42
SMN1; SMN2 Q16637 5/20 0.42
MAPT P10636 5/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
KDM4E B2RXH2 2/20 0.40
ALDH1A1 P00352 3/20 0.40
HPGD P15428 2/20 0.40
LMNA P02545 2/20 0.40
MAPK1 P28482 1/20 0.40
MEN1 O00255 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
KMT2A Q03164 1/20 0.38
SLC1A5 Q15758 1/20 0.38
F2 P00734 1/20 0.38

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
SCHEMBL7624090 0.92 LMNA (0.46) MCHR1SCN1ASCN2ASCN3AALDH1A1
SCHEMBL7629409 0.88 MCHR1 (0.43) MCHR1SCN1ASCN2ASCN3APDCD1
SCHEMBL7625600 0.85 TDP1 (0.41) SCN1ASCN2ASCN3ASMN1; SMN2MAPT
SCHEMBL7625553 0.85 MEN1 (0.42) MCHR1SMN1; SMN2ALDH1A1HPGDLMNA
SCHEMBL7627352 0.85 SCN1A (0.47) MCHR1SCN1ASCN2ASCN3APDCD1
SCHEMBL7631393 0.83 CA1 (0.45) SMN1; SMN2MAPTKDM4EALDH1A1LMNA
SCHEMBL7625398 0.82 MEN1 (0.44) MCHR1SCN1ASCN2ASCN3APDCD1
SCHEMBL7625336 0.82 MAPT (0.40) MAPTL3MBTL1ALDH1A1HPGDLMNA
SCHEMBL7633912 0.82 PLK1 (0.40) MCHR1SMN1; SMN2MAPTL3MBTL1KDM4E
SCHEMBL7628276 0.82 CYP19A1 (0.33) MCHR1HPGDNPC1RAB9A

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-1233014-A1 ASYMMETRIC ORGANIC PEROXIDE, CROSSLINKING AGENT COMPRISING THE SAME, AND METHOD OF CROSSLINKING WITH THE SAME NOF CORPORATION (JP) 2002-08-21 EP disclosed