SCHEMBL7628441

SCHEMBL7628441

Cc1ccc(C(=O)OO[C]2CCCC2)cc1C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.46
MAPT P10636 6/20 0.41
HTT P42858 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
CES2 O00748 1/20 0.41
CES1 P23141 1/20 0.41
NPC1 O15118 6/20 0.41
RAB9A P51151 5/20 0.41
HPGD P15428 4/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
ALDH1A1 P00352 3/20 0.40
CYP1A2 P05177 2/20 0.40
CYP3A4 P08684 2/20 0.40
CYP2C9 P11712 2/20 0.40
CYP2C19 P33261 2/20 0.40
CYP2D6 P10635 1/20 0.40
POLB P06746 2/20 0.39
LMNA P02545 2/20 0.38
GAA P10253 1/20 0.38
ALOX15 P16050 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
SCHEMBL7634249 0.98 KMT2A (0.44) KMT2AMAPTHTTSMN1; SMN2CES2
SCHEMBL7623552 0.98 KMT2A (0.44) KMT2AMAPTHTTSMN1; SMN2CES2
SCHEMBL7629617 0.82 KMT2A (0.41) KMT2AMAPTHTTSMN1; SMN2CES2
SCHEMBL7626946 0.81 TDP1 (0.50) KMT2AMAPTSMN1; SMN2CES2CES1
SCHEMBL7625721 0.80 TDP1 (0.48) KMT2AMAPTSMN1; SMN2CES2CES1
SCHEMBL7623860 0.80 TDP1 (0.48) KMT2AMAPTSMN1; SMN2CES2CES1
SCHEMBL7627887 0.79 KMT2A (0.50) KMT2AMAPTNPC1RAB9AHPGD
SCHEMBL7631816 0.78 KMT2A (0.49) KMT2AMAPTNPC1RAB9AHPGD
SCHEMBL7628543 0.78 KMT2A (0.49) KMT2AMAPTNPC1RAB9AHPGD
SCHEMBL7631634 0.78 MAPT (0.56) KMT2AMAPTSMN1; SMN2NPC1RAB9A

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