SCHEMBL9117613

SCHEMBL9117613

CCCCCCCCCCCCCCC(C#N)COCCC(=O)OCC

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.42
MAPT P10636 1/20 0.41
LMNA P02545 2/20 0.40
ALDH1A1 P00352 1/20 0.40
KMT2A Q03164 2/20 0.39
KDM4E B2RXH2 1/20 0.39
DUSP3 P51452 1/20 0.39
MEN1 O00255 1/20 0.39
PRKCA P17252 1/20 0.38
PRKCE Q02156 1/20 0.38
PRKCQ Q04759 1/20 0.38
PRKCD Q05655 1/20 0.38
DNM1 Q05193 1/20 0.37
CYP3A4 P08684 1/20 0.37
TSHR P16473 1/20 0.37
ATM Q13315 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
PLA2G2C Q5R387 2/20 0.37
PAM P19021 2/20 0.36

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
SCHEMBL9658247 0.80 ENPP2 (0.48) DGKAMAPTLMNAALDH1A1PRKCA
SCHEMBL8745342 0.79 ZDHHC7 (0.41) DGKAMAPTKMT2AMEN1ATM
SCHEMBL3807700 0.78 DGKA (0.68) DGKAMAPTLMNAALDH1A1KMT2A
SCHEMBL3814829 0.77 DGKA (0.61) DGKAMAPTLMNAALDH1A1KMT2A
SCHEMBL20528143 0.76 ZDHHC7 (0.45) MAPTLMNAALDH1A1KMT2AKDM4E
SCHEMBL10476477 0.76 CYP3A4 (0.53) DGKAMAPTLMNAALDH1A1KMT2A
SCHEMBL7627156 0.75 DGKA (0.57) DGKAMAPTLMNAALDH1A1KMT2A
SCHEMBL10012275 0.74 CYP3A4 (0.56) DGKAMAPTLMNAALDH1A1KMT2A
SCHEMBL10011628 0.74 CYP3A4 (0.60) DGKAMAPTLMNAALDH1A1KMT2A
SCHEMBL20528144 0.72 ZDHHC7 (0.41) MAPTLMNAALDH1A1KMT2AKDM4E

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-1995026371-A1 INTERMEDIATES FOR THE PREPARATION OF POLY(CYANOACRYLATES) AND APPLICATIONS OF THE POLY(CYANOACRYLATES) SO PREPARED PATRIQUE LIMITED (IE) 1995-10-05 WO disclosed