SCHEMBL4175256

SCHEMBL4175256

CC(C)C(C(=O)NC(Cc1ccccc1)C(=O)O)N1C=CCNC1=O

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MME P08473 8/20 0.46
ACE P12821 6/20 0.46
CPA1 P15085 5/20 0.46
ACE2 Q9BYF1 5/20 0.46
MMP2 P08253 1/20 0.43
MMP7 P09237 1/20 0.43
MMP9 P14780 1/20 0.43
MMP12 P39900 1/20 0.43
MMP13 P45452 1/20 0.43

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
SCHEMBL4174128 0.85 CYP3A4 (0.41)
SCHEMBL4175252 0.78 ABCC3 (0.55) MMEACECPA1ACE2MMP2
SCHEMBL12864507 0.71 MME (0.69) MMEACECPA1ACE2MMP2
SCHEMBL8510053 0.71 MME (0.69) MMEACECPA1ACE2MMP2
SCHEMBL8510050 0.71 MME (0.69) MMEACECPA1ACE2MMP2
SCHEMBL13915883 0.71 ABCC3 (0.54) MMP2MMP7
SCHEMBL31390164 0.70 MME (0.63) MMEACECPA1ACE2MMP2
SCHEMBL31390141 0.70 MME (0.63) MMEACECPA1ACE2MMP2
SCHEMBL15222315 0.70 MME (0.67) MMEACECPA1ACE2MMP2
SCHEMBL13907784 0.70 ABCC3 (0.53) MMEACECPA1ACE2MMP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090068719-A1 IMMUNOASSAYS, HAPTENS, IMMUNOGENS AND ANTIBODIES FOR ANTI-HIV THERAPEUTICS VALDEZ JOHNNY 2009-03-12 US disclosed
US-20050244816-A1 Immunoassays, haptens, immunogens and antibodies for anti-HIV therapeutics ARK DIAGNOSTICS, INC. (US) 2005-11-03 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 (2 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-20090068719-A1 IMMUNOASSAYS, HAPTENS, IMMUNOGENS AND ANTIBODIES FOR ANTI-HIV THERAPEUTICS CD4, MPI, ME1 MME 26/4885ACE 7/4885CPA1 754/4885
US-20050244816-A1 Immunoassays, haptens, immunogens and antibodies for anti-HIV therapeutics CD4, MPI, ME1 MME 26/4885ACE 7/4885CPA1 754/4885

“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.