SCHEMBL7794185

SCHEMBL7794185

C=CCCCCCCCCC=O.CC(C)=CCCC(C)C=O

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 3/20 0.40
TSHR P16473 3/20 0.40
ALDH1A1 P00352 4/20 0.38
USP2 O75604 4/20 0.38
MAPT P10636 3/20 0.38
CYP3A4 P08684 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
HPGD P15428 1/20 0.38
LMNA P02545 2/20 0.36
RECQL P46063 1/20 0.36
ABCC4 O15439 1/20 0.33

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
Decanal SCHEMBL8208889 0.94 TSHR (0.44) ALOX15TSHRALDH1A1USP2MAPT
SCHEMBL17242080 0.81 ALOX15 (0.55) ALOX15TSHRALDH1A1USP2HPGD
SCHEMBL29785 0.81 ALOX15 (0.55) ALOX15TSHRALDH1A1USP2HPGD
SCHEMBL17967768 0.81 ALOX15 (0.55) ALOX15TSHRALDH1A1USP2HPGD
SCHEMBL28249306 0.80 TSHR (0.42) ALOX15TSHRALDH1A1USP2MAPT
SCHEMBL9853371 0.78 ALOX15 (0.44) ALOX15TSHRALDH1A1
SCHEMBL9853369 0.78 ALOX15 (0.44) ALOX15TSHRALDH1A1
Undecanal SCHEMBL8210493 0.78 TSHR (0.53) TSHRALDH1A1USP2MAPTCYP3A4
SCHEMBL23019164 0.77 TSHR (0.44) TSHRALDH1A1USP2MAPTCYP3A4
SCHEMBL3126461 0.77 TSHR (0.44) TSHRALDH1A1USP2MAPTCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20010005711-A1 Perfume compositions comprising 4,8-dimethyl-3,7-nonadien-2-one SYMRISE GMBH & CO. KG (DE) 2001-06-28 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-20010005711-A1 Perfume compositions comprising 4,8-dimethyl-3,7-nonadien-2-one DEK, DPM1, DEGS1 ALOX15 868/4885TSHR 4800/4885ALDH1A1 1546/4885

“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.