SCHEMBL7625600

SCHEMBL7625600

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

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.41
SCN1A P35498 1/20 0.40
SCN2A Q99250 1/20 0.40
SCN3A Q9NY46 1/20 0.40
RAB9A P51151 7/20 0.37
KMT2A Q03164 3/20 0.37
GAA P10253 2/20 0.37
NPC1 O15118 4/20 0.36
ALDH1A1 P00352 2/20 0.36
MAPT P10636 2/20 0.36
MMP13 P45452 1/20 0.36
LMNA P02545 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
ESR1 P03372 1/20 0.35
CA7 P43166 1/20 0.35
CA9 Q16790 1/20 0.35
ESR2 Q92731 1/20 0.35

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
SCHEMBL7625553 0.89 MEN1 (0.42) TDP1RAB9AKMT2ANPC1ALDH1A1
SCHEMBL7624090 0.87 LMNA (0.46) TDP1SCN1ASCN2ASCN3AKMT2A
SCHEMBL7630333 0.87 SCN1A (0.37) TDP1SCN1ASCN2ASCN3ARAB9A
SCHEMBL7631393 0.86 CA1 (0.45) RAB9AKMT2ANPC1ALDH1A1MAPT
SCHEMBL7630727 0.85 KMT2A (0.43) RAB9AKMT2ANPC1ALDH1A1LMNA
SCHEMBL7625336 0.85 MAPT (0.40) TDP1RAB9AKMT2ANPC1ALDH1A1
SCHEMBL7626074 0.85 MCHR1 (0.46) SCN1ASCN2ASCN3ARAB9AKMT2A
SCHEMBL7628276 0.85 CYP19A1 (0.33) RAB9ANPC1
SCHEMBL7633912 0.85 PLK1 (0.40) RAB9AKMT2AGAANPC1ALDH1A1
SCHEMBL7632245 0.84 RAB9A (0.38) RAB9AKMT2ANPC1MAPTLMNA

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