SCHEMBL7628940

SCHEMBL7628940

CC1CC[C](OOC(=O)c2ccc(-c3ccccc3)cc2)C(C)C1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN1A P35498 1/20 0.43
SCN2A Q99250 1/20 0.43
SCN3A Q9NY46 1/20 0.43
TRPM8 Q7Z2W7 1/20 0.42
PDCD1 Q15116 1/20 0.41
CD274 Q9NZQ7 1/20 0.41
SMN1; SMN2 Q16637 4/20 0.40
MCHR1 Q99705 1/20 0.38
MEN1 O00255 2/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
KMT2A Q03164 2/20 0.38
MAPT P10636 2/20 0.37
KDM4E B2RXH2 1/20 0.37
F2 P00734 1/20 0.37
LMNA P02545 1/20 0.37
CHRNA7 P36544 2/20 0.36
HTR3E A5X5Y0 1/20 0.36
HTR3B O95264 1/20 0.36
HTR3A P46098 1/20 0.36

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
SCHEMBL7627584 0.92 LMNA (0.44) TRPM8MEN1KMT2AF2LMNA
SCHEMBL7633363 0.85 TDP1 (0.40) SCN1ASCN2ASCN3ASMN1; SMN2MEN1
SCHEMBL7628217 0.83 SCN1A (0.44) SCN1ASCN2ASCN3APDCD1CD274
SCHEMBL7627674 0.83 CA1 (0.44) SMN1; SMN2MEN1NPC1RAB9AKMT2A
SCHEMBL7627663 0.83 MEN1 (0.40) SMN1; SMN2MEN1NPC1RAB9AKMT2A
SCHEMBL7627888 0.82 ALDH1A1 (0.31) SMN1; SMN2MAPTKDM4EHPGD
SCHEMBL7626604 0.82 POLB (0.41) SMN1; SMN2MEN1NPC1RAB9AKMT2A
SCHEMBL7630884 0.82 TRPV1 (0.43) SMN1; SMN2MEN1RAB9AKMT2AMAPT
SCHEMBL7627352 0.81 SCN1A (0.47) SCN1ASCN2ASCN3ATRPM8PDCD1
SCHEMBL7631618 0.81 SCN1A (0.44) SCN1ASCN2ASCN3ATRPM8PDCD1

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