SCHEMBL8766016

SCHEMBL8766016

C=CC(=O)NC(C)(CCCC)CC(C)C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ZDHHC20 Q5W0Z9 1/20 0.41
ZDHHC2 Q9UIJ5 1/20 0.41
TSHR P16473 3/20 0.36
ALDH1A1 P00352 3/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
THRA P10827 1/20 0.33
THRB P10828 1/20 0.33
HPGD P15428 2/20 0.33
CA2 P00918 4/20 0.32
CA1 P00915 3/20 0.32
MAPK1 P28482 2/20 0.32
FAAH O00519 1/20 0.32
GAA P10253 1/20 0.32
MMP8 P22894 1/20 0.31
CNR1 P21554 1/20 0.31
CNR2 P34972 1/20 0.31

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
SCHEMBL8765999 0.90 TSHR (0.38) ZDHHC20ZDHHC2TSHRALDH1A1CYP3A4
SCHEMBL8764497 0.85 ZDHHC20 (0.44) ZDHHC20ZDHHC2TSHRALDH1A1CYP3A4
SCHEMBL9397172 0.85 ZDHHC20 (0.44) ZDHHC20ZDHHC2TSHRALDH1A1CYP3A4
SCHEMBL8765395 0.85 TSHR (0.39) ZDHHC20ZDHHC2TSHRALDH1A1CYP3A4
SCHEMBL19069207 0.83 ZDHHC20 (0.51) ZDHHC20ZDHHC2TSHRALDH1A1CYP3A4
SCHEMBL21450645 0.81 ZDHHC20 (0.53) ZDHHC20ZDHHC2TSHRALDH1A1CYP3A4
SCHEMBL29192590 0.81 ZDHHC20 (0.42) ZDHHC20ZDHHC2TSHRALDH1A1CYP3A4
SCHEMBL6232093 0.81 CYP3A4 (0.39) ZDHHC20ZDHHC2TSHRALDH1A1CYP3A4
SCHEMBL1073217 0.79 ALDH1A1 (0.49) ZDHHC20ZDHHC2TSHRALDH1A1CYP3A4
SCHEMBL8765940 0.78 MEN1 (0.50) ZDHHC20ZDHHC2TSHRALDH1A1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0505972-B1 Process for producing styrenic copolymer IDEMITSU KOSAN CO (JP) 1997-06-11 EP disclosed
EP-0490269-B1 Graft copolymer and process for producing the same IDEMITSU KOSAN CO (JP) 1996-02-28 EP disclosed
US-5250629-A Graft polymerization of styrene and ethylenically unsaturated monomer using transition metal catalysts, organoaluminum compounds; films, packaging, automobile parts IDEMITSU KOSAN CO., LTD. (JP) 1993-10-05 US disclosed
EP-0505972-A2 Process for producing styrenic copolymer IDEMITSU KOSAN COMPANY LIMITED (JP) 1992-09-30 EP disclosed
EP-0490269-A1 Graft copolymer and process for producing the same IDEMITSU KOSAN COMPANY LIMITED (JP) 1992-06-17 EP disclosed