SCHEMBL84330

SCHEMBL84330

CC(CC(C)(C)C(=O)ONS)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 2/20 0.39
RIPK1 Q13546 2/20 0.39
MME P08473 4/20 0.38
HPGD P15428 2/20 0.38
ALDH1A1 P00352 1/20 0.38
SLC6A4 P31645 1/20 0.37
RAB9A P51151 2/20 0.37
NPC1 O15118 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C19 P33261 1/20 0.37

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
SCHEMBL25604264 0.84 KMT2A (0.44) TRPA1RIPK1HPGDALDH1A1RAB9A
SCHEMBL17123620 0.83 RIPK1 (0.46) TRPA1RIPK1HPGDALDH1A1
SCHEMBL16523042 0.79 TRPA1 (0.41) TRPA1RIPK1HPGDALDH1A1
SCHEMBL585429 0.77 TRPA1 (0.48) TRPA1RIPK1HPGDRAB9ANPC1
SCHEMBL13202632 0.75 FABP7 (0.39) TRPA1RIPK1HPGDALDH1A1
SCHEMBL12258178 0.75 HPGD (0.46) TRPA1RIPK1HPGDALDH1A1RAB9A
SCHEMBL4270025 0.74 TAAR1 (0.47) TRPA1RIPK1
SCHEMBL17880780 0.74 TRPA1 (0.46) TRPA1RIPK1HPGDALDH1A1RAB9A
SCHEMBL19757388 0.74 TRPA1 (0.37) TRPA1RIPK1HPGDALDH1A1
SCHEMBL25548120 0.74 TSHR (0.45) HPGDALDH1A1RAB9ANPC1CYP3A4

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
US-8129505-B2 Formed by catalytic polymerization; antibody conjugates UCB PHARMA S.A. (BE) 2012-03-06 US disclosed
US-20080220005-A1 Comb Polymers UCB PHARMA S.A. (BE) 2008-09-11 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-20080220005-A1 Comb Polymers C9, F13B, PYM1 TRPA1 4686/4885RIPK1 1805/4885MME 4118/4885

“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.