SCHEMBL8612937

SCHEMBL8612937

C=C(C)C(=O)CCO[C]=O

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.31
ALDH1A1 P00352 1/20 0.31
TSHR P16473 2/20 0.31

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
SCHEMBL5021630 0.81 TDP1 (0.35) THRBALDH1A1TSHR
SCHEMBL1387290 0.79
SCHEMBL9869091 0.77
SCHEMBL8825039 0.75
SCHEMBL92114 0.75
SCHEMBL6725175 0.73
SCHEMBL28381521 0.73 ALDH1A1 (0.44) THRBALDH1A1TSHR
SCHEMBL15759387 0.72 TDP1 (0.44) THRBALDH1A1TSHR
SCHEMBL164046 0.72 THRB (0.57) THRBALDH1A1TSHR
SCHEMBL26062583 0.72 EPHX2 (0.30)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113150007-B Photochromic indeno-fused ring pyran compounds 光学转变公司 2024-03-08 CN disclosed
EP-0605149-B1 Recording sheet JUJO PAPER CO LTD (JP) 1998-04-22 EP disclosed
US-5482913-A CARBONATE TYPE BLOCKED COLOR DEVELOPER, LASER RECORDING NIPPON PAPER INDUSTRIES, CO., LTD. (JP) 1996-01-09 US disclosed
EP-0605149-A2 Recording sheet NIPPON PAPER INDUSTRIES CO., LTD. (JP) 1994-07-06 EP disclosed