SCHEMBL14192540

SCHEMBL14192540

C=CC(=O)c1ccc(OC(=O)C2CCC(C3CCC(C4CCC(CCC)CC4)CC3)CC2)cc1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ELANE P08246 2/20 0.44
KMT2A Q03164 2/20 0.41
HTT P42858 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
THRB P10828 10/20 0.41
THRA P10827 7/20 0.40
F2 P00734 1/20 0.40
POLB P06746 1/20 0.39
CYP2C9 P11712 1/20 0.39
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 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
SCHEMBL14192399 1.00 ELANE (0.44) ELANEKMT2AHTTSMN1; SMN2TDP1
SCHEMBL14192324 0.96 ELANE (0.47) ELANEKMT2AHTTSMN1; SMN2TDP1
SCHEMBL14192385 0.93 ELANE (0.44) ELANEKMT2AHTTSMN1; SMN2TDP1
SCHEMBL14192424 0.92 THRB (0.44) ELANEKMT2AHTTSMN1; SMN2TDP1
SCHEMBL14192321 0.88 THRB (0.47) ELANEKMT2AHTTSMN1; SMN2TDP1
SCHEMBL14192564 0.86 F2 (0.43) ELANEKMT2AHTTSMN1; SMN2TDP1
SCHEMBL14192403 0.85 THRB (0.44) ELANEKMT2AHTTSMN1; SMN2TDP1
SCHEMBL3617483 0.85 THRB (0.51) ELANEKMT2AHTTSMN1; SMN2TDP1
SCHEMBL3617484 0.85 THRB (0.51) ELANEKMT2AHTTSMN1; SMN2TDP1
SCHEMBL13135346 0.83 HTT (0.58) ELANEKMT2AHTTSMN1; SMN2TDP1

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-7357964-B2 Liquid-crystalline vinyl ketone derivatives and their polymers CHISSO CORPORATION (JP) 2008-04-15 US disclosed