SCHEMBL17615501

SCHEMBL17615501

CCCC(O)CN(CCCN(C)C)CC(O)CCC

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 3/20 0.38
KDM4E B2RXH2 2/20 0.34
MAPK1 P28482 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
HTR2A P28223 1/20 0.33
HRH1 P35367 1/20 0.33
ALDH1A1 P00352 1/20 0.33
TSHR P16473 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL19677889 0.87 DNM1 (0.48) DNM1L3MBTL1
SCHEMBL5423731 0.86 DNM1 (0.41) DNM1KDM4EMAPK1TDP1HTR2A
SCHEMBL25587775 0.85 L3MBTL1 (0.39) DNM1KDM4EMAPK1TDP1L3MBTL1
SCHEMBL5892049 0.83 RAB9A (0.33) DNM1KDM4EMAPK1TDP1ALDH1A1
SCHEMBL5408876 0.83 DNM1 (0.48) DNM1KDM4EMAPK1TDP1L3MBTL1
SCHEMBL5406861 0.83 DNM1 (0.48) DNM1KDM4EMAPK1TDP1L3MBTL1
SCHEMBL5414617 0.83 DNM1 (0.48) DNM1KDM4EMAPK1TDP1L3MBTL1
SCHEMBL5412524 0.83 DNM1 (0.48) DNM1KDM4EMAPK1TDP1L3MBTL1
SCHEMBL5412471 0.83 DNM1 (0.48) DNM1KDM4EMAPK1TDP1L3MBTL1
SCHEMBL5406792 0.83 DNM1 (0.48) DNM1KDM4EMAPK1TDP1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12018080-B2 Methods and compositions for treating cancer by targeting the CLEC2D-KLRB1 pathway THE BROAD INSTITUTE, INC. (US) 2024-06-25 US disclosed
US-20240018552-A1 NOVEL CRISPR ENZYMES AND SYSTEMS MASSACHUSETTS INSTITUTE OF TECHNOLOGY 2024-01-18 US disclosed
US-20160082126-A1 NANOCOMPLEXES FOR DELIVERY OF SAPORIN UNIV TUFTS (US) 2016-03-24 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 (3 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-12018080-B2 Methods and compositions for treating cancer by targeting the CLEC2D-KLRB1 pathway KLRK1, CD47, FCGR3B DNM1 3022/4885KDM4E 810/4885MAPK1 1799/4885
US-20240018552-A1 NOVEL CRISPR ENZYMES AND SYSTEMS CPSF1, CPSF6, CPN1 DNM1 3631/4885KDM4E 540/4885MAPK1 4861/4885
US-20160082126-A1 NANOCOMPLEXES FOR DELIVERY OF SAPORIN SARNP, SAP30BP, SCP2 DNM1 3713/4885KDM4E 3977/4885MAPK1 3612/4885

“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.