SCHEMBL22367606

SCHEMBL22367606

C=CC(=O)NCCCC(C)(C)SO

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ZDHHC20 Q5W0Z9 1/20 0.53
ZDHHC2 Q9UIJ5 1/20 0.53
GAA P10253 1/20 0.46
ALDH1A1 P00352 2/20 0.42
TSHR P16473 2/20 0.42
MAPK1 P28482 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
TGM2 P21980 8/20 0.36
KMT2A Q03164 3/20 0.35
MEN1 O00255 1/20 0.35
MAPT P10636 1/20 0.33
ATM Q13315 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
KMT5A Q9NQR1 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
SCHEMBL28778155 0.79 ZDHHC20 (0.53) ZDHHC20ZDHHC2GAAALDH1A1TSHR
SCHEMBL4344395 0.78 ZDHHC20 (0.61) ZDHHC20ZDHHC2GAAALDH1A1TSHR
SCHEMBL24119207 0.76 ZDHHC20 (0.65) ZDHHC20ZDHHC2GAAALDH1A1TSHR
SCHEMBL4653768 0.76 ZDHHC20 (0.55) ZDHHC20ZDHHC2GAAALDH1A1TSHR
SCHEMBL24932940 0.76 ZDHHC20 (0.46) ZDHHC20ZDHHC2GAAALDH1A1TSHR
Ammonia Solution, Strong SCHEMBL29386805 0.76 ZDHHC20 (0.59) ZDHHC20ZDHHC2GAAALDH1A1TSHR
SCHEMBL9067240 0.76 ZDHHC20 (0.50) ZDHHC20ZDHHC2GAAALDH1A1TSHR
SCHEMBL20925263 0.76 ZDHHC20 (0.50) ZDHHC20ZDHHC2GAAALDH1A1TSHR
SCHEMBL632264 0.76 ZDHHC20 (0.75) ZDHHC20ZDHHC2GAAALDH1A1TSHR
SCHEMBL1561467 0.76 ZDHHC20 (0.68) ZDHHC20ZDHHC2GAAALDH1A1TSHR

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
EP-3494168-B9 POLYMER COMPOSITIONS CONTAINING GRAFTED POLYMERIC NETWORKS AND PROCESSES FOR THEIR PREPARATION AND USE JOHNSON & JOHNSON VISION CARE (US) 2020-08-26 EP disclosed