SCHEMBL3246348

SCHEMBL3246348

CCCCCCCCCCC1(C)C=C(C)C(=O)O1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 4/20 0.40
MMP9 P14780 4/20 0.40
MMP3 P08254 1/20 0.40
MMP8 P22894 2/20 0.39
MMP13 P45452 2/20 0.39
PTPN1 P18031 4/20 0.38
ACP1 P24666 3/20 0.38
CDC25B P30305 3/20 0.38
MEN1 O00255 1/20 0.36
GAA P10253 1/20 0.36
ALOX12 P18054 1/20 0.36
KMT2A Q03164 1/20 0.36
ALOX5 P09917 8/20 0.36
SIRT2 Q8IXJ6 1/20 0.35

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
SCHEMBL3239425 1.00 MMP2 (0.40) MMP2MMP9MMP3MMP8MMP13
SCHEMBL3239913 1.00 MMP2 (0.40) MMP2MMP9MMP3MMP8MMP13
SCHEMBL3242954 0.93 ALDH1A1 (0.35) MMP2MMP9MMP3PTPN1ACP1
SCHEMBL4656839 0.90 MMP9 (0.34) MMP2MMP9MMP3MMP8MMP13
SCHEMBL3750812 0.77
SCHEMBL17307320 0.76 SIRT2 (0.38) MMP2MMP9MMP3PTPN1ACP1
SCHEMBL3237199 0.74 AKT1 (0.32) MMP9
SCHEMBL3239526 0.67 ACHE (0.43) PTPN1ACP1CDC25BALOX5
SCHEMBL21415447 0.64 PTPN1 (0.45) MMP2MMP9MMP3MMP8MMP13
SCHEMBL21961902 0.63 SIRT2 (0.45) PTPN1ACP1CDC25BSIRT2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100291275-A1 Flavorant and Fragrance Furan-2(5H)-One Compounds GIVAUDAN SA (CH) 2010-11-18 US disclosed
EP-1996569-B1 FLAVORANT AND FRAGRANCE COMPOUNDS GIVAUDAN SA (CH) 2010-07-28 EP disclosed
EP-1996569-A1 FLAVORANT AND FRAGRANCE COMPOUNDS Givaudan SA (CH) 2008-12-03 EP disclosed
WO-2007107023-A1 FLAVORANT AND FRAGRANCE COMPOUNDS GIVAUDAN SA (CH) 2007-09-27 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-20100291275-A1 Flavorant and Fragrance Furan-2(5H)-One Compounds TAS2R5, TAS2R1, TAS1R1 MMP2 4652/4885MMP9 4578/4885MMP3 4784/4885

“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.