SCHEMBL1149476

SCHEMBL1149476

CCOC(=O)NCC=COC(N)=O

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ALOX15 P16050 1/20 0.42
▸ GAA P10253 3/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ MGAM O43451 1/20 0.33
▸ SI P14410 1/20 0.33
▸ MGAM2 Q2M2H8 1/20 0.33
▸ KMT2A Q03164 3/20 0.33
▸ TSHR P16473 2/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ GLA P06280 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.31
▸ ACHE P22303 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ NPC1 O15118 1/20 0.30
▸ HPGD P15428 1/20 0.30
▸ CRHBP P24387 1/20 0.30
▸ RAB9A P51151 1/20 0.30
▸ CRHR2 Q13324 1/20 0.30

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
SCHEMBL1149475 1.00 ALOX15 (0.42) ALOX15GAAL3MBTL1MGAMSI
SCHEMBL28815661 0.76 GAA (0.39) ALOX15GAAL3MBTL1MGAMSI
SCHEMBL2338040 0.76 GAA (0.39) ALOX15GAAL3MBTL1MGAMSI
SCHEMBL12003317 0.74 GLA (0.39) ALOX15GAAL3MBTL1MGAMSI
SCHEMBL3260744 0.73 HCAR2 (0.48) GAAL3MBTL1MGAMSIMGAM2
SCHEMBL11601388 0.71 GLA (0.41) GAAL3MBTL1MGAMSIMGAM2
SCHEMBL12393899 0.71 NR1I2 (0.45) ALOX15GAAMGAMSIMGAM2
SCHEMBL9772247 0.71 GAA (0.36) GAAL3MBTL1MGAMSIMGAM2
SCHEMBL1147121 0.71 — —
SCHEMBL2335067 0.71 CYP2C9 (0.41) GAAL3MBTL1MGAMSIMGAM2

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-20110034510-A1 ENANTIOMER-ENRICHED ALPHA-,OMEGA-AMINO ALCOHOL DERIVATIVES, THEIR PRODUCTION AND USE AS INSECT- AND MITE-REPELLING AGENTS SALTIGO GMBH (DE) 2011-02-10 — — US disclosed
US-5008261-A Long-lasting BAYER AKTIENGESELLSCHAFT (DE) 1991-04-16 — — US disclosed
US-4900834-A INSECT AND MITE REPELLENTS BAYER AKTIENGESELLSCHAFT (DE) 1990-02-13 — — 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-20110034510-A1 ENANTIOMER-ENRICHED ALPHA-,OMEGA-AMINO ALCOHOL DERIVATIVES, THEIR PRODUCTION AND USE AS INSECT- AND MITE-REPELLING AGENTS CHRM1, CHRNE, YWHAZ ALOX15 154/4885GAA 4861/4885L3MBTL1 80/4885

“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.

Send feedback