SCHEMBL20073434

SCHEMBL20073434

CC(C)NCCCCCCCC(=O)NCCOCCOCCOCCNC(=O)C(C)C

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
GLP1R P43220 8/20 0.44
TSHR P16473 1/20 0.37
ADRB2 P07550 3/20 0.37
ADRB1 P08588 3/20 0.37
HPGD P15428 1/20 0.36
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
FAAH O00519 2/20 0.36
ENPP2 Q13822 1/20 0.35
LPAR1 Q92633 1/20 0.35
LPAR2 Q9HBW0 1/20 0.35
ALDH1A1 P00352 1/20 0.35

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
SCHEMBL25836510 0.85 KMT2A (0.49) MEN1KMT2AGLP1RTSHRADRB2
SCHEMBL21106234 0.83 KMT2A (0.61) MEN1KMT2ATSHRADRB2HTT
SCHEMBL21106165 0.83 KMT2A (0.61) MEN1KMT2ATSHRADRB2HTT
SCHEMBL18908759 0.83 KMT2A (0.61) MEN1KMT2ATSHRADRB2HTT
SCHEMBL18908752 0.83 KMT2A (0.61) MEN1KMT2ATSHRADRB2HTT
SCHEMBL25834730 0.83 KMT2A (0.61) MEN1KMT2ATSHRADRB2HTT
SCHEMBL23807051 0.82 KMT2A (0.49) MEN1KMT2ATSHRALDH1A1
SCHEMBL22837695 0.82 KMT2A (0.58) MEN1KMT2ATSHRHTTSMN1; SMN2
SCHEMBL22794306 0.82 TSHR (0.53) MEN1KMT2AGLP1RTSHRHPGD
SCHEMBL26866002 0.82 MEN1 (0.41) MEN1KMT2AGLP1RTSHRADRB2

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
US-20180104354-A1 CHIMERIC ANTIGEN RECEPTOR T CELL SWITCHES AND USES THEREOF THE SCRIPPS RESEARCH INSTITUTE 2018-04-19 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20180104354-A1 CHIMERIC ANTIGEN RECEPTOR T CELL SWITCHES AND USES THEREOF ICOS, HAVCR2, CD2 MEN1 4384/4885KMT2A 1833/4885GLP1R 2991/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.