SCHEMBL14609923

SCHEMBL14609923

CCNC(=O)c1ccc(OC(=O)C2CCC(C(=O)Oc3ccc(C(=O)OCC)cc3)CC2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 3/20 0.52
▸ ELANE P08246 1/20 0.47
▸ HTT P42858 3/20 0.46
▸ KMT2A Q03164 4/20 0.44
▸ MEN1 O00255 2/20 0.44
▸ SMN1; SMN2 Q16637 3/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44
▸ NPC1 O15118 2/20 0.44
▸ GAA P10253 1/20 0.44
▸ ALDH1A1 P00352 2/20 0.44
▸ POLB P06746 2/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ PRSS1 P07477 1/20 0.43
▸ ACR P10323 1/20 0.43
▸ CA12 O43570 1/20 0.43
▸ CA1 P00915 1/20 0.43
▸ CA2 P00918 1/20 0.43
▸ ESR1 P03372 1/20 0.43
▸ CA7 P43166 1/20 0.43
▸ CA9 Q16790 1/20 0.43

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
SCHEMBL4544912 0.89 RAB9A (0.58) RAB9AELANEHTTKMT2AMEN1
SCHEMBL14510047 0.85 RAB9A (0.55) RAB9AELANEHTTKMT2ASMN1; SMN2
SCHEMBL26186181 0.84 RAB9A (0.53) RAB9AELANEHTTKMT2AMEN1
SCHEMBL9671988 0.82 CA1 (0.61) RAB9AHTTKMT2AMEN1SMN1; SMN2
SCHEMBL8595912 0.79 PTGER4 (0.47) RAB9AELANEHTTKMT2AMEN1
Hydrochloric Acid SCHEMBL11276582 0.78 PTGER4 (0.46) RAB9AELANEHTTKMT2AMEN1
Hydrochloric Acid SCHEMBL8600970 0.78 PTGER4 (0.46) RAB9AELANEHTTKMT2AMEN1
SCHEMBL4544914 0.78 LMNA (0.59) RAB9AELANEHTTKMT2AMEN1
SCHEMBL3282161 0.77 RAB9A (0.46) RAB9AELANEHTTKMT2AMEN1
SCHEMBL13198392 0.76 MAPT (0.56) RAB9AELANEHTTKMT2AMEN1

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
WO-2007021028-A1 OPTICAL COMPENSATION FILM, POLARIZING PLATE AND LIQUID CRYSTAL DISPLAY FUJIFILM CORPORATION (JP) 2007-02-22 — — WO disclosed
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