SCHEMBL30209147

SCHEMBL30209147

CCCCCC(=O)CCC1C=CC(=O)C1CC=CCCCC(=O)O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TRPA1 O75762 5/20 0.59
▸ MEN1 O00255 3/20 0.59
▸ ALDH1A1 P00352 3/20 0.59
▸ KMT2A Q03164 3/20 0.59
▸ HPGD P15428 3/20 0.59
▸ LMNA P02545 2/20 0.59
▸ POLB P06746 1/20 0.59
▸ NR4A1 P22736 1/20 0.59
▸ PTPN7 P35236 1/20 0.59
▸ SMN1; SMN2 Q16637 1/20 0.59
▸ HIF1A Q16665 1/20 0.59
▸ MAPT P10636 5/20 0.55
▸ UCHL3 P15374 1/20 0.55
▸ PPARG P37231 6/20 0.51
▸ RECQL P46063 2/20 0.51
▸ TDP1 Q9NUW8 2/20 0.51
▸ MIF P14174 1/20 0.51
▸ GALR3 O60755 1/20 0.50
▸ EP300 Q09472 1/20 0.48
▸ PPARD Q03181 3/20 0.47

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
SCHEMBL21631706 1.00 TRPA1 (0.59) TRPA1MEN1ALDH1A1KMT2AHPGD
SCHEMBL2948519 0.90 TRPA1 (0.61) TRPA1MEN1ALDH1A1KMT2AHPGD
SCHEMBL2948516 0.90 TRPA1 (0.61) TRPA1MEN1ALDH1A1KMT2AHPGD
SCHEMBL2738718 0.88 TRPA1 (0.46) TRPA1MEN1ALDH1A1KMT2AHPGD
SCHEMBL3439784 0.88 TRPA1 (0.46) TRPA1MEN1ALDH1A1KMT2AHPGD
SCHEMBL10020985 0.88 TRPA1 (0.46) TRPA1MEN1ALDH1A1KMT2AHPGD
SCHEMBL19732190 0.87 TRPA1 (0.64) TRPA1MEN1ALDH1A1KMT2AHPGD
SCHEMBL2760341 0.86 TRPA1 (0.44) TRPA1MEN1ALDH1A1KMT2AHPGD
SCHEMBL10052300 0.86 TRPA1 (0.44) TRPA1MEN1ALDH1A1KMT2AHPGD
SCHEMBL11866056 0.83 PPARG (0.61) TRPA1MEN1ALDH1A1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12226769-B2 Sample manipulation and assay with rapid temperature change ESSENLIX CORPORATION (US) 2025-02-18 — — US disclosed
US-20230400469-A1 RAPID INTRA-CELLULAR ASSAY ESSENLIX CORPORATION (US) 2023-12-14 — — US disclosed
US-20230021254-A1 RAPID INTRA-CELLULAR ASSAY AND USE OF THE SAME ESSENLIX CORPORATION (US) 2023-01-19 — — US disclosed
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