SCHEMBL12201010

SCHEMBL12201010

CCNC(=O)C(N)Cc1ccc(O)cc1

nearest known ligand 0.76

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 1/20 0.59
MMP2 P08253 2/20 0.54
TAAR1 Q96RJ0 2/20 0.50
SLC6A2 P23975 1/20 0.50
LNPEP Q9UIQ6 3/20 0.49
ERAP2 Q6P179 2/20 0.49
YARS1 P54577 2/20 0.49

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
SCHEMBL10885518 1.00 SLC7A5 (0.59) SLC7A5MMP2TAAR1SLC6A2LNPEP
SCHEMBL9054297 0.87 SLC7A5 (0.56) SLC7A5MMP2
SCHEMBL13972848 0.87 CSK (0.46) SLC7A5MMP2LNPEPERAP2
SCHEMBL13382056 0.85 MMP2 (0.56) SLC7A5MMP2
SCHEMBL6653906 0.85 ALPI (0.59) SLC7A5MMP2
SCHEMBL988104 0.85 ALPI (0.59) SLC7A5MMP2
SCHEMBL25080948 0.84 CHRND (0.56)
SCHEMBL19102898 0.84 SLC7A5 (0.53) SLC7A5MMP2LNPEPERAP2YARS1
SCHEMBL10974111 0.84 SLC7A5 (0.60) SLC7A5MMP2LNPEPERAP2YARS1
SCHEMBL8975673 0.84 SLC7A5 (0.60) SLC7A5MMP2LNPEPERAP2YARS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110263539-A1 SHIP 1 MODULATOR COMPOUNDS THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2011-10-27 US disclosed
US-8034365-B2 Polymer substituted with amide or thioamide groups; vascular stents, bioreabsorbable polymers REVA MEDICAL, INC. (US) 2011-10-11 US disclosed
US-20100323990-A1 SHIP 1 MODULATOR PRODRUGS THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2010-12-23 US disclosed
US-20090011977-A1 Novel Lipopeptides as Antibacterial Agents HILL JASON 2009-01-08 US disclosed
US-20080287347-A1 Novel Lipopeptides as Antibacterial Agents CUBIST PHARMACEUTICALS, INC. 2008-11-20 US disclosed
US-7408025-B2 Lipopeptides as antibacterial agents CUBIST PHARMACEUTICALS, INC. (US) 2008-08-05 US disclosed
US-20080112999-A1 N-SUBSTITUTED MONOMERS AND POLYMERS REVA MEDICAL, INC. (US) 2008-05-15 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-20100323990-A1 SHIP 1 MODULATOR PRODRUGS PPM1D, PPM1G, PPM1F SLC7A5 3768/4885MMP2 4267/4885TAAR1 596/4885
US-20080287347-A1 Novel Lipopeptides as Antibacterial Agents CLPTM1, NGLY1, VIP SLC7A5 3306/4885MMP2 1347/4885TAAR1 4451/4885
US-20110263539-A1 SHIP 1 MODULATOR COMPOUNDS PPM1F, PPM1D, PPP1R1B SLC7A5 4451/4885MMP2 4412/4885TAAR1 1789/4885
US-20090011977-A1 Novel Lipopeptides as Antibacterial Agents CLPTM1, NGLY1, VIP SLC7A5 3306/4885MMP2 1347/4885TAAR1 4451/4885

“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.