SCHEMBL15655554

SCHEMBL15655554

CCCCc1ccc(-c2nc(C)c(C(=O)NCC(O)CO)s2)cc1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.52
NPC1 O15118 2/20 0.52
PPARA Q07869 12/20 0.47
PPARG P37231 3/20 0.47
GAA P10253 3/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
ALDH1A1 P00352 3/20 0.46
MAPT P10636 1/20 0.46
NPSR1 Q6W5P4 1/20 0.44
PPARD Q03181 4/20 0.44

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
SCHEMBL15655552 1.00 HPGD (0.52) HPGDNPC1PPARAPPARGGAA
SCHEMBL15655839 1.00 HPGD (0.52) HPGDNPC1PPARAPPARGGAA
SCHEMBL15656795 0.83 GAA (0.55) HPGDNPC1PPARAPPARGGAA
SCHEMBL15655693 0.80 HPGD (0.53) HPGDNPC1PPARAPPARGGAA
SCHEMBL15679907 0.78 RAB9A (0.63) HPGDNPC1GAASMN1; SMN2ALDH1A1
SCHEMBL15656009 0.77 LMNA (0.53) HPGDNPC1GAASMN1; SMN2ALDH1A1
SCHEMBL15655355 0.76 GAA (0.51) HPGDNPC1PPARAPPARGGAA
SCHEMBL15654437 0.74 GAA (0.49) HPGDNPC1PPARAPPARGGAA
SCHEMBL15655691 0.74 RAB9A (0.62) HPGDNPC1GAASMN1; SMN2ALDH1A1
SCHEMBL15655911 0.73 RAB9A (0.60) HPGDNPC1GAASMN1; SMN2ALDH1A1

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-9353072-B2 Antimicrobial substituted thiazoles and methods of use PURDUE RESEARCH FOUNDATION (US) 2016-05-31 US disclosed
US-20140121249-A1 ANTIMICROBIAL SUBSTITUTED THIAZOLES AND METHODS OF USE PURDUE RESEARCH FOUNDATION 2014-05-01 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-20140121249-A1 ANTIMICROBIAL SUBSTITUTED THIAZOLES AND METHODS OF USE CLPP, ELANE, NOD2 HPGD 1785/4885NPC1 538/4885PPARA 183/4885

“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.