SCHEMBL21402271

SCHEMBL21402271

CCC(COCC(CC)Cc1ccc(O)c(OC)c1)Cc1ccc(O)c(OC)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FOS P01100 1/20 0.62
▸ TTR P02766 1/20 0.62
▸ JUN P05412 1/20 0.62
▸ NR3C1 P04150 1/20 0.62
▸ HSD17B1 P14061 1/20 0.62
▸ HSD17B2 P37059 1/20 0.62
▸ CYP3A4 P08684 2/20 0.59
▸ MMP1 P03956 1/20 0.59
▸ ALOX15 P16050 3/20 0.57
▸ ALOX12 P18054 3/20 0.57
▸ TAAR1 Q96RJ0 2/20 0.51
▸ TSHR P16473 2/20 0.51
▸ MAPK1 P28482 1/20 0.51
▸ CALM1 P0DP23 1/20 0.51
▸ LMNA P02545 1/20 0.50
▸ GLA P06280 1/20 0.50
▸ ALDH1A1 P00352 2/20 0.49
▸ GAA P10253 2/20 0.49
▸ PTPN1 P18031 2/20 0.49
▸ NFKB1 P19838 1/20 0.49

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
SCHEMBL21402285 0.85 FOS (0.59) FOSTTRJUNNR3C1HSD17B1
SCHEMBL21402277 0.83 FOS (0.56) FOSTTRJUNNR3C1HSD17B1
SCHEMBL21402268 0.81 FOS (0.54) FOSTTRJUNNR3C1HSD17B1
SCHEMBL23263167 0.80 FOS (0.73) FOSTTRJUNNR3C1HSD17B1
SCHEMBL3158709 0.78 FOS (0.66) FOSTTRJUNNR3C1HSD17B1
SCHEMBL11571527 0.77 FOS (0.80) FOSTTRJUNNR3C1HSD17B1
Mesodihydroguaiaretic Acid SCHEMBL974725 0.77 FOS (1.00) FOSTTRJUNNR3C1HSD17B1
Dihydroguaiaretic Acid SCHEMBL9087980 0.77 FOS (1.00) FOSTTRJUNNR3C1HSD17B1
SCHEMBL27074592 0.77 FOS (0.74) FOSTTRJUNNR3C1HSD17B1
SCHEMBL14515677 0.77 CYP3A4 (0.64) FOSTTRJUNNR3C1HSD17B1

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
EP-3569671-B1 METHYLMENTHOL DERIVATIVE AND COOL-SENSATION IMPARTER COMPOSITION CONTAINING SAME TAKASAGO PERFUMERY CO LTD (JP) 2022-06-22 — — EP claimed
EP-3275962-B1 METHYL MENTHOL DERIVATIVE AND COOLING AGENT COMPOSITION CONTAINING SAME TAKASAGO PERFUMERY CO LTD (JP) 2019-10-02 — — EP claimed
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