SCHEMBL13806003

SCHEMBL13806003

COc1cc(COC(COC(=O)c2cc(OC)c(OC)c(OC)c2)C(COC(=O)c2cc(OC)c(OC)c(OC)c2)OC(=O)c2cc(OC)c(OC)c(OC)c2)cc(OC)c1OC

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 1/20 0.46
▸ KMT2A Q03164 2/20 0.45
▸ PTPN1 P18031 1/20 0.45
▸ SLC29A1 Q99808 3/20 0.45
▸ SCN1A P35498 1/20 0.44
▸ SCN2A Q99250 1/20 0.44
▸ SCN3A Q9NY46 1/20 0.44
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ MAPK1 P28482 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ USP2 O75604 1/20 0.42
▸ TSHR P16473 1/20 0.42
▸ TNFRSF1A P19438 1/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ CYP2D6 P10635 1/20 0.42
▸ THPO P40225 1/20 0.42
▸ MTOR P42345 1/20 0.42

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
SCHEMBL2612552 0.89 SLC29A1 (0.54) HTTKMT2APTPN1SLC29A1SCN1A
SCHEMBL14093363 0.83 PTPN1 (0.54) KMT2APTPN1SLC29A1SCN1ASCN2A
SCHEMBL13806005 0.83 MAPT (0.50) HTTKMT2ASMN1; SMN2MAPK1TSHR
SCHEMBL2612567 0.78 PTPN1 (0.68) HTTKMT2APTPN1SLC29A1SCN1A
SCHEMBL13806006 0.77 MEN1 (0.42) HTTKMT2APTPN1KDM4ETSHR
SCHEMBL9910014 0.75 SLC29A1 (0.56) HTTKMT2ASLC29A1SCN1ASCN2A
SCHEMBL2612566 0.74 TSHR (0.61) KMT2APTPN1SMN1; SMN2KDM4EMAPK1
SCHEMBL11848930 0.74 SLC29A1 (0.55) HTTKMT2ASLC29A1SCN1ASCN2A
SCHEMBL13956101 0.74 PTPN1 (0.74) KMT2APTPN1SLC29A1SCN1ASCN2A
SCHEMBL27921550 0.73 KMT2A (0.60) KMT2ASLC29A1SMN1; SMN2MAPK1TSHR

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090142515-A1 Cellulose Ester Film, Process for Producing Cellulose Ester Film, Optical Film, Polarization Plate and Liquid Crystal Display Unit KONICA MINOLTA OPTO, INC. (JP) 2009-06-04 — — US disclosed
US-20090142515-A1 Cellulose Ester Film, Process for Producing Cellulose Ester Film, Optical Film, Polarization Plate and Liquid Crystal Display Unit KONICA MINOLTA OPTO, INC. (JP) 2009-06-04 — — US disclosed
Send feedback