SCHEMBL3152155

SCHEMBL3152155

CC1(C)CCCC2(C)C(=O)CCC=C12

nearest known ligand 0.41

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.41
CACNA1G O43497 1/20 0.38
CYP19A1 P11511 1/20 0.31

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
SCHEMBL4773740 0.70 ACHE (0.39) ACHECACNA1GCYP19A1
SCHEMBL4942302 0.70 ACHE (0.39) ACHECACNA1GCYP19A1
SCHEMBL3152488 0.70 ACHE (0.39) ACHECACNA1GCYP19A1
SCHEMBL3155245 0.70 ACHE (0.39) ACHECACNA1GCYP19A1
SCHEMBL3146268 0.70 ACHE (0.39) ACHECACNA1GCYP19A1
SCHEMBL3151569 0.70 ACHE (0.39) ACHECACNA1GCYP19A1
SCHEMBL3156464 0.70 ACHE (0.39) ACHECACNA1GCYP19A1
SCHEMBL11067595 0.69 CACNA1G (0.33) ACHECACNA1G
SCHEMBL21319092 0.66 CYP19A1 (0.32) CYP19A1
SCHEMBL6249506 0.65 HCAR2 (0.40) CYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1910262-B1 NAPHTHALENONE DERIVATIVE WITH POWDERY-IONONE TYPE ODOURS FIRMENICH & CIE (CH) 2010-03-03 EP claimed
US-20080214419-A1 Naphthalenone Derivative with Powdery-Ionone Type Odors FIRMENICH SA (CH) 2008-09-04 US claimed
EP-1910262-A1 NAPHTHALENONE DERIVATIVE WITH POWDERY-IONONE TYPE ODOURS FIRMENICH SA (CH) 2008-04-16 EP claimed
WO-2007010420-A1 NAPHTHALENONE DERIVATIVE WITH POWDERY-IONONE TYPE ODOURS FIRMENICH SA (CH) 2007-01-25 WO claimed
EP-1910262-B1 NAPHTHALENONE DERIVATIVE WITH POWDERY-IONONE TYPE ODOURS FIRMENICH & CIE (CH) 2010-03-03 EP disclosed
US-20080214419-A1 Naphthalenone Derivative with Powdery-Ionone Type Odors FIRMENICH SA (CH) 2008-09-04 US disclosed
EP-1910262-A1 NAPHTHALENONE DERIVATIVE WITH POWDERY-IONONE TYPE ODOURS FIRMENICH SA (CH) 2008-04-16 EP disclosed
WO-2007010420-A1 NAPHTHALENONE DERIVATIVE WITH POWDERY-IONONE TYPE ODOURS FIRMENICH SA (CH) 2007-01-25 WO 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-20080214419-A1 Naphthalenone Derivative with Powdery-Ionone Type Odors IPO5, TRPA1, SCN5A ACHE 2973/4885CACNA1G 716/4885CYP19A1 799/4885

“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.