SCHEMBL4863907

SCHEMBL4863907

CC(=O)OC(F)C(F)(F)F

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.43
TDP1 Q9NUW8 1/20 0.35
CHRM2 P08172 1/20 0.33
CHRM4 P08173 1/20 0.33
CHRM1 P11229 1/20 0.33
TBXA2R P21731 1/20 0.33
GALR3 O60755 1/20 0.32
MAPT P10636 1/20 0.32
BLM P54132 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
ALDH1A1 P00352 2/20 0.32
ALOX15 P16050 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
SCHEMBL20508245 0.82 TSHR (0.42) TSHRTDP1CHRM2CHRM4CHRM1
SCHEMBL701398 0.80 TSHR (0.40) TSHRTDP1CHRM2CHRM4CHRM1
SCHEMBL29207112 0.80 TSHR (0.40) TSHRTDP1CHRM2CHRM4CHRM1
SCHEMBL29031302 0.80 TSHR (0.40) TSHRTDP1CHRM2CHRM4CHRM1
SCHEMBL5704617 0.78 TSHR (0.39) TSHRTDP1CHRM2CHRM4CHRM1
SCHEMBL21749881 0.78
SCHEMBL18421875 0.78
SCHEMBL16856029 0.77 ALDH1A1 (0.31) ALDH1A1
SCHEMBL12019080 0.77 TSHR (0.42) TSHRTDP1CHRM2CHRM4CHRM1
SCHEMBL20547899 0.77 TSHR (0.37) TSHRTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119613745-A Preparation method and application of series of zirconium-based MOFs and electrochromic film thereof 南开大学 2025-03-14 CN claimed
CN-119433209-A Method for extracting and preparing metal lithium from waste lithium ion battery 西南科技大学 2025-02-14 CN claimed
CN-119433209-A Method for extracting and preparing metal lithium from waste lithium ion battery 西南科技大学 2025-02-14 CN disclosed
CN-117996151-A Lithium secondary battery SK新能源株式会社 2024-05-07 CN disclosed
US-7364763-B1 Method for selective delivery of lipid-soluble antioxidants into the polar lipid fraction of a food product UNIVERSITY OF MASSACHUSETTS (US) 2008-04-29 US disclosed
WO-2001032040-A1 METHOD FOR SELECTIVE DELIVERY OF LIPID-SOLUBLE ANTIOXIDANTS INTO THE POLAR LIPID FRACTION OF A FOOD PRODUCT UNIVERSITY OF MASSACHUSETTS (US) 2001-05-10 WO disclosed