SCHEMBL2768791

SCHEMBL2768791

CCCCC/C=C(/C#N)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ ALDH1A1 P00352 6/20 0.42
▸ MAPK1 P28482 3/20 0.42
▸ MAPT P10636 2/20 0.42
▸ RAB9A P51151 2/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ CES2 O00748 3/20 0.40
▸ CES1 P23141 3/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ TBXAS1 P24557 1/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ PTGS2 P35354 1/20 0.39
▸ NAAA Q02083 1/20 0.38
▸ APP P05067 1/20 0.38
▸ EP300 Q09472 1/20 0.37
▸ SOAT2 O75908 1/20 0.36

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
SCHEMBL2767621 1.00 SMN1; SMN2 (0.46) SMN1; SMN2ALDH1A1MAPK1MAPTRAB9A
SCHEMBL13990397 1.00 SMN1; SMN2 (0.46) SMN1; SMN2ALDH1A1MAPK1MAPTRAB9A
SCHEMBL31284893 0.98 SMN1; SMN2 (0.45) SMN1; SMN2ALDH1A1MAPK1MAPTRAB9A
SCHEMBL31285033 0.98 SMN1; SMN2 (0.45) SMN1; SMN2ALDH1A1MAPK1MAPTRAB9A
SCHEMBL31285016 0.98 SMN1; SMN2 (0.45) SMN1; SMN2ALDH1A1MAPK1MAPTRAB9A
SCHEMBL31284710 0.98 SMN1; SMN2 (0.45) SMN1; SMN2ALDH1A1MAPK1MAPTRAB9A
SCHEMBL31285494 0.98 SMN1; SMN2 (0.45) SMN1; SMN2ALDH1A1MAPK1MAPTRAB9A
SCHEMBL31310782 0.95 SMN1; SMN2 (0.43) SMN1; SMN2ALDH1A1MAPK1MAPTRAB9A
SCHEMBL3174321 0.88 SMN1; SMN2 (0.46) SMN1; SMN2ALDH1A1MAPK1MAPTRAB9A
SCHEMBL3175863 0.88 SMN1; SMN2 (0.46) SMN1; SMN2ALDH1A1MAPK1MAPTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1824952-B1 ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2010-04-28 — — EP claimed
US-20100021413-A1 Malodor Counteracting Compositions GIVAUDAN SA (CH) 2010-01-28 — — US claimed
EP-2086594-A1 MALODOR COUNTERACTING COMPOSITIONS Givaudan SA (CH) 2009-08-12 — — EP claimed
US-20080306170-A1 Organic Compounds GIVAUDAN SA (CH) 2008-12-11 — — US claimed
WO-2008055372-A1 MALODOR COUNTERACTING COMPOSITIONS GIVAUDAN SA (CH) 2008-05-15 — — WO claimed
CN-101072857-A Organic compounds GIVAUDAN SA (CH) 2007-11-14 — — CN claimed
EP-4731734-A1 FRAGRANCE INGREDIENTS Givaudan SA (CH) 2026-04-29 — — EP disclosed
WO-2024261137-A1 FRAGRANCE INGREDIENTS GIVAUDAN SA (CH) 2024-12-26 — — WO disclosed
EP-4481022-A1 FRAGRANCE INGREDIENTS Givaudan SA (CH) 2024-12-25 — — EP disclosed
US-9102899-B2 Organic compounds GIVAUDAN SA (CH) 2015-08-11 — — US disclosed
EP-1824952-B1 ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2010-04-28 — — EP disclosed
US-20100021413-A1 Malodor Counteracting Compositions GIVAUDAN SA (CH) 2010-01-28 — — US disclosed
EP-2086594-A1 MALODOR COUNTERACTING COMPOSITIONS Givaudan SA (CH) 2009-08-12 — — EP disclosed
US-20080306170-A1 Organic Compounds GIVAUDAN SA (CH) 2008-12-11 — — US disclosed
WO-2008055372-A1 MALODOR COUNTERACTING COMPOSITIONS GIVAUDAN SA (CH) 2008-05-15 — — WO disclosed
CN-101072857-A Organic compounds GIVAUDAN SA (CH) 2007-11-14 — — CN 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-20080306170-A1 Organic Compounds PNN, TRPA1, PAOX SMN1; SMN2 899/4885ALDH1A1 257/4885MAPK1 3761/4885

“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.

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