SCHEMBL8401130

SCHEMBL8401130

CC1C(C(=O)O)CC(S(=O)(=O)O)CC1(C)C(=O)O

nearest known ligand 0.32

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GRM4 Q14833 4/20 0.32
CYP2C19 P33261 2/20 0.32
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
CYP1A2 P05177 1/20 0.32
KMT2A Q03164 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
GRM8 O00222 1/20 0.32
GRM6 O15303 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 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
SCHEMBL22345753 0.77 GRM4 (0.41) GRM4CYP2C19MEN1ALDH1A1CYP1A2
SCHEMBL10957627 0.69
SCHEMBL28511613 0.66 SLC6A12 (0.38) GRM4CYP2C19MEN1ALDH1A1CYP1A2
SCHEMBL320791 0.63 F10 (0.33) GRM4CYP2C19MEN1ALDH1A1CYP1A2
SCHEMBL25330082 0.63
SCHEMBL19557132 0.63
SCHEMBL17479965 0.63
SCHEMBL5317323 0.63
SCHEMBL5314714 0.63
SCHEMBL459480 0.63

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
US-5942465-A Thermal dye transfer assemblage with low TG polymeric receiver mixture EASTMAN KODAK COMPANY (US) 1999-08-24 US disclosed
US-5939355-A CATIONIC DYE EASTMAN KODAK COMPANY (US) 1999-08-17 US disclosed