SCHEMBL1858634

SCHEMBL1858634

CC(O)CCCCCCC#N

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.42
TRPV1 Q8NER1 1/20 0.37
TRPA1 O75762 1/20 0.37
ALDH1A1 P00352 2/20 0.35
MAPT P10636 2/20 0.35
TDP1 Q9NUW8 2/20 0.33
USP2 O75604 1/20 0.32
CYP3A4 P08684 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
SPHK1 Q9NYA1 1/20 0.32
GBA1 P04062 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
SCHEMBL2566688 0.97
SCHEMBL8611024 0.90
SCHEMBL6137517 0.83 MAPT (0.44) TSHRTRPV1ALDH1A1MAPTCYP3A4
SCHEMBL6137511 0.83 MAPT (0.44) TSHRTRPV1ALDH1A1MAPTCYP3A4
SCHEMBL6137524 0.83 MAPT (0.44) TSHRTRPV1ALDH1A1MAPTCYP3A4
SCHEMBL3613683 0.81
SCHEMBL15912049 0.81 TRPV1 (0.42) TSHRTRPV1TRPA1ALDH1A1MAPT
SCHEMBL14604144 0.81 TRPV1 (0.42) TSHRTRPV1TRPA1ALDH1A1MAPT
SCHEMBL15912048 0.81 TRPV1 (0.42) TSHRTRPV1TRPA1ALDH1A1MAPT
SCHEMBL3905502 0.81

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011054628-A1 ENHANCED PHOTO PROTECTION UNILEVER PLC (GB) 2011-05-12 WO disclosed
US-20110104082-A1 ENHANCED PHOTO PROTECTION CONOPCO, INC., D/B/A UNILEVER (US) 2011-05-05 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-20110104082-A1 ENHANCED PHOTO PROTECTION ERCC1, PCNA, CUTA TSHR 4481/4885TRPV1 355/4885TRPA1 94/4885

“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.