SCHEMBL7628409

SCHEMBL7628409

Cc1ccc(C(=O)OO[C]2CCCC(C)C2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.40
SCN1A P35498 1/20 0.40
SCN2A Q99250 1/20 0.40
SCN3A Q9NY46 1/20 0.40
SMN1; SMN2 Q16637 5/20 0.37
RAB9A P51151 5/20 0.37
NPC1 O15118 4/20 0.37
LMNA P02545 3/20 0.37
GAA P10253 3/20 0.37
KDM4E B2RXH2 1/20 0.37
CYP1A2 P05177 2/20 0.36
HPGD P15428 1/20 0.36
CYP2C19 P33261 1/20 0.36
ALDH1A1 P00352 7/20 0.36
MAPT P10636 5/20 0.36
TP53 P04637 1/20 0.36
POLB P06746 1/20 0.36
KMT2A Q03164 4/20 0.35
CYP2C9 P11712 1/20 0.35
MEN1 O00255 1/20 0.34

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
SCHEMBL7636387 0.87 LMNA (0.44) TDP1SCN1ASCN2ASCN3ASMN1; SMN2
SCHEMBL7629912 0.86 CA1 (0.44) SMN1; SMN2RAB9ANPC1LMNAGAA
SCHEMBL7635475 0.86 MEN1 (0.42) TDP1SMN1; SMN2RAB9ANPC1LMNA
SCHEMBL7625661 0.85 SCN1A (0.43) SCN1ASCN2ASCN3ASMN1; SMN2RAB9A
SCHEMBL7631498 0.85 KMT2A (0.43) SMN1; SMN2RAB9ANPC1LMNAGAA
SCHEMBL7628949 0.85 SMN1; SMN2 (0.38) TDP1SMN1; SMN2RAB9ANPC1GAA
SCHEMBL7631506 0.85 TP53 (0.43) TDP1SMN1; SMN2RAB9ALMNAGAA
SCHEMBL7629538 0.84 MAPT (0.43) SMN1; SMN2RAB9ANPC1LMNAGAA
SCHEMBL7635530 0.84 MAPT (0.35) SMN1; SMN2RAB9ANPC1LMNAGAA
SCHEMBL7667203 0.84 TDP1 (0.46) TDP1SCN1ASCN2ASCN3ASMN1; SMN2

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