SCHEMBL25527221

SCHEMBL25527221

CCC(C)(CC)C(C)(CC(C)(C)C)C(=O)OC

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.34
ALDH1A1 P00352 1/20 0.30
POLB P06746 1/20 0.30
TSHR P16473 1/20 0.30
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL18488705 0.86 DGAT1 (0.33) DGAT1
SCHEMBL12783512 0.86 DGAT1 (0.33) DGAT1
SCHEMBL14355440 0.83 DGAT1 (0.34) DGAT1ALDH1A1POLBTSHRHSD17B10
SCHEMBL178785 0.83 DGAT1 (0.34) DGAT1ALDH1A1POLBTSHRHSD17B10
SCHEMBL31752 0.80 DGAT1 (0.38) DGAT1TSHRHSD17B10
SCHEMBL13771858 0.77 LMNA (0.34) DGAT1ALDH1A1HSD17B10
SCHEMBL13946434 0.77 LMNA (0.34) DGAT1ALDH1A1HSD17B10
SCHEMBL23709462 0.77 TSHR (0.36) DGAT1TSHRHSD17B10
SCHEMBL18432078 0.77 DGAT1 (0.35) DGAT1TSHRHSD17B10
SCHEMBL10065563 0.76 DGAT1 (0.38) DGAT1ALDH1A1POLBTSHR

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
WO-2023085512-A1 ANTIBACTERIAL ANTI-STATIC COMPOSITION, AND RUST-PROOF FILM COMPRISING SAME 대진첨단소재 주식회사 2023-05-19 WO disclosed