SCHEMBL889191

SCHEMBL889191

CCCNC(=O)CCN(CCCN(CCC(=O)NCCC)CCC(=O)NCCC)CCC(=O)NCCC

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 2/20 0.49
FAAH O00519 4/20 0.47
CASP2 P42575 1/20 0.47
CNR1 P21554 1/20 0.45
NAAA Q02083 1/20 0.44
ICMT O60725 2/20 0.44
ALB P02768 2/20 0.44
GAA P10253 1/20 0.43
MCL1 Q07820 1/20 0.42
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
EPHX1 P07099 1/20 0.39
KDM5A P29375 1/20 0.39

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
SCHEMBL889199 0.94 DNM1 (0.51) DNM1FAAHCASP2CNR1NAAA
SCHEMBL17615499 0.93 NAAA (0.47) DNM1FAAHCASP2CNR1NAAA
SCHEMBL19546069 0.91 CASP2 (0.52) DNM1FAAHCASP2CNR1NAAA
SCHEMBL889136 0.90 MCL1 (0.48) DNM1FAAHCASP2CNR1NAAA
SCHEMBL19681637 0.89 DNM1 (0.56) DNM1FAAHCASP2CNR1NAAA
SCHEMBL19726631 0.88 DNM1 (0.49) DNM1FAAHCASP2CNR1NAAA
SCHEMBL889148 0.88 PAOX (0.45) DNM1FAAHCASP2CNR1NAAA
SCHEMBL12792384 0.87 CASP2 (0.67) DNM1FAAHCASP2NAAAICMT
SCHEMBL12791957 0.87 CASP2 (0.67) DNM1FAAHCASP2NAAAICMT
SCHEMBL12791707 0.87 CASP2 (0.67) DNM1FAAHCASP2NAAAICMT

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 4 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
US-20120009222-A1 MODULATION OF THE IMMUNE RESPONSE MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2012-01-12 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 (4 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-20120009222-A1 MODULATION OF THE IMMUNE RESPONSE FCGRT, MYD88, C3AR1 DNM1 4279/4885FAAH 858/4885CASP2 2840/4885
US-12018080-B2 Methods and compositions for treating cancer by targeting the CLEC2D-KLRB1 pathway KLRK1, CD47, FCGR3B DNM1 3022/4885FAAH 4542/4885CASP2 2004/4885
US-20240018552-A1 NOVEL CRISPR ENZYMES AND SYSTEMS CPSF1, CPSF6, CPN1 DNM1 3631/4885FAAH 3839/4885CASP2 2457/4885
US-20160082126-A1 NANOCOMPLEXES FOR DELIVERY OF SAPORIN SARNP, SAP30BP, SCP2 DNM1 3713/4885FAAH 3722/4885CASP2 1350/4885

“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.