SCHEMBL23937123

SCHEMBL23937123

CCNCCCOCOCC

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 2/20 0.46
MEN1 O00255 1/20 0.46
GLA P06280 1/20 0.46
KMT2A Q03164 1/20 0.46
CYP1A2 P05177 1/20 0.44
TSHR P16473 1/20 0.44
KDM4E B2RXH2 4/20 0.41
POLB P06746 3/20 0.41
THRB P10828 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
SAT1 P21673 3/20 0.40
KDM1A O60341 5/20 0.38
ALDH1A1 P00352 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL5932334 0.91 KDM4E (0.43) CYP2C19MEN1GLAKMT2ACYP1A2
SCHEMBL4236221 0.88
SCHEMBL5933774 0.84 ALDH1A1 (0.42) CYP2C19MEN1GLAKMT2ACYP1A2
SCHEMBL13822687 0.83 CYP2C19 (0.58) CYP2C19MEN1GLAKMT2ACYP1A2
SCHEMBL13492945 0.81 CYP2C19 (0.55) CYP2C19MEN1GLAKMT2ACYP1A2
SCHEMBL12380906 0.79 CYP2C19 (0.52) CYP2C19MEN1GLAKMT2ACYP1A2
SCHEMBL1252986 0.78 KDM4E (0.52) CYP2C19MEN1GLAKMT2ACYP1A2
SCHEMBL23633796 0.77 ALOX15 (0.35) TSHRKDM4EPOLBTHRBTDP1
SCHEMBL14930298 0.76 TSHR (0.55) CYP2C19MEN1GLAKMT2ACYP1A2
SCHEMBL5932636 0.76 TSHR (0.50) CYP2C19MEN1GLAKMT2ACYP1A2

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-3473611-B1 TRIALKYL CATIONIC LIPIDS AND METHODS OF USE THEREOF ARBUTUS BIOPHARMA CORP (CA) 2021-10-20 EP disclosed