SCHEMBL9507265

SCHEMBL9507265

C=C(C)C(=O)OC.O=C1CCCC(=O)O1

nearest known ligand 0.56

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.56
TSHR P16473 2/20 0.36
KMT2A Q03164 1/20 0.34
ATM Q13315 1/20 0.34
THRB P10828 1/20 0.32

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
Methacrylic Acid SCHEMBL337845 0.95 ALDH1A1 (0.50) ALDH1A1TSHRKMT2AATM
Butyrolactone SCHEMBL27965320 0.82 ALDH1A1 (0.52) ALDH1A1TSHRKMT2AATM
SCHEMBL4363488 0.80 ALDH1A1 (0.71) ALDH1A1TSHRKMT2AATMTHRB
SCHEMBL7778762 0.80 CA1 (0.52) ALDH1A1TSHRKMT2AATM
SCHEMBL9078238 0.78 ALDH1A1 (0.56) ALDH1A1TSHRKMT2AATMTHRB
SCHEMBL8167037 0.78 ALDH1A1 (0.56) ALDH1A1TSHRKMT2AATM
SCHEMBL5432413 0.77 ALDH1A1 (0.83) ALDH1A1TSHRKMT2AATMTHRB
SCHEMBL8408211 0.77 ALDH1A1 (0.83) ALDH1A1TSHRKMT2AATMTHRB
SCHEMBL20530993 0.77 ALDH1A1 (0.83) ALDH1A1TSHRKMT2AATMTHRB
Cyclohexane SCHEMBL489150 0.77 ALDH1A1 (0.83) ALDH1A1TSHRKMT2AATMTHRB

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-0267574-B1 HEAT RESISTANT COPOLYMER COMPOSITION Sumitomo Dow Limited (JP) 1993-09-01 EP disclosed
US-4877833-A BLEND OF POLYMERS OF SPECIFIC COMPOSITION SUMITOMO NAUGATUCK CO., LTD. (JP) 1989-10-31 US disclosed