SCHEMBL20045170

SCHEMBL20045170

CCC1CCC(C(=O)Oc2ccc(OC(=O)C3CCC(C(=O)Oc4ccc(OC(=O)C5CCC(CC)CC5)cc4)CC3)cc2)CC1

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.61
HTT P42858 1/20 0.61
SMN1; SMN2 Q16637 1/20 0.61
TDP1 Q9NUW8 1/20 0.61
ELANE P08246 2/20 0.54
F2 P00734 1/20 0.54
POLB P06746 2/20 0.46
HPGD P15428 3/20 0.46
L3MBTL1 Q9Y468 1/20 0.45
ATM Q13315 1/20 0.43
CA2 P00918 1/20 0.41
MEN1 O00255 1/20 0.41
MAPT P10636 1/20 0.41
CYP19A1 P11511 1/20 0.40

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
SCHEMBL12154218 1.00 KMT2A (0.61) KMT2AHTTSMN1; SMN2TDP1ELANE
SCHEMBL17059002 0.94 KMT2A (0.54) KMT2AHTTSMN1; SMN2TDP1ELANE
SCHEMBL20443893 0.94 KMT2A (0.54) KMT2AHTTSMN1; SMN2TDP1ELANE
SCHEMBL12154151 0.94 HTT (0.54) KMT2AHTTSMN1; SMN2TDP1ELANE
SCHEMBL8449391 0.92 KMT2A (0.53) KMT2AHTTSMN1; SMN2TDP1ELANE
SCHEMBL8044641 0.92 KMT2A (0.53) KMT2AHTTSMN1; SMN2TDP1ELANE
SCHEMBL1895159 0.92 KMT2A (0.53) KMT2AHTTSMN1; SMN2TDP1ELANE
SCHEMBL11406644 0.91 HTT (0.51) KMT2AHTTSMN1; SMN2TDP1ELANE
SCHEMBL19077961 0.91 F2 (0.53) KMT2AHTTSMN1; SMN2TDP1ELANE
SCHEMBL11122345 0.91 ELANE (0.57) KMT2AHTTSMN1; SMN2TDP1ELANE

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
US-20180100103-A1 POLYMERIZABLE COMPOSITION CONTAINING POLYMERIZABLE COMPOUND, FILM, HALF MIRROR FOR DISPLAYING PROJECTION IMAGE, AND POLYMERIZABLE COMPOUND FUJIFILM CORPORATION (JP) 2018-04-12 US disclosed