SCHEMBL27338484

SCHEMBL27338484

CCC(C)(C)OC(=O)OOC(C)(C)C

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.34
ALDH1A1 P00352 2/20 0.34
TDP1 Q9NUW8 2/20 0.34
HSD17B10 Q99714 1/20 0.34
HDAC1 Q13547 1/20 0.30
HDAC2 Q92769 1/20 0.30
HDAC6 Q9UBN7 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
SCHEMBL5136985 0.89 TSHR (0.35) TSHRALDH1A1TDP1
SCHEMBL16738135 0.86 ALDH1A1 (0.39) TSHRALDH1A1TDP1
SCHEMBL27338248 0.85 ALDH1A1 (0.32) TSHRALDH1A1TDP1
SCHEMBL27338251 0.85 ALDH1A1 (0.32) TSHRALDH1A1TDP1
SCHEMBL27338481 0.84 ALDH1A1 (0.31) TSHRALDH1A1TDP1HSD17B10
SCHEMBL27338483 0.83 HSD17B10 (0.33) TSHRALDH1A1TDP1HSD17B10
SCHEMBL27338223 0.82 LMNA (0.32) TSHRALDH1A1TDP1HSD17B10
SCHEMBL27338221 0.82 ALDH1A1 (0.30) TSHRALDH1A1TDP1
SCHEMBL475144 0.81 TSHR (0.43) TSHRALDH1A1TDP1
SCHEMBL27338480 0.81 ALDH1A1 (0.33) TSHRALDH1A1TDP1HSD17B10

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
US-20240218154-A1 OLEFIN-BASED POLYMER AND PEROXIDE COMPOSITIONS WITH EXCELLENT CURE RESPONSE DOW GLOBAL TECHNOLOGIES LLC (US) 2024-07-04 US disclosed