SCHEMBL8398652

SCHEMBL8398652

C=C1OC(=O)CC1CCCCCC

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.48
TSHR P16473 1/20 0.48
CYP1A2 P05177 3/20 0.44
PPARG P37231 2/20 0.39
TYR P14679 1/20 0.38
POLB P06746 1/20 0.38
FASN P49327 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.36
HTT P42858 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
EPHX1 P07099 1/20 0.35
PRKCA P17252 1/20 0.35

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
SCHEMBL8397498 0.98 ALDH1A1 (0.45) ALDH1A1TSHRCYP1A2PPARGTYR
SCHEMBL8398071 0.93 ALDH1A1 (0.43) ALDH1A1TSHRCYP1A2PPARGTYR
SCHEMBL8398416 0.85 ALDH1A1 (0.38) ALDH1A1TSHRCYP1A2
SCHEMBL9234966 0.82 ALDH1A1 (0.62) ALDH1A1TSHRCYP1A2PPARGL3MBTL1
SCHEMBL8529727 0.82 ALDH1A1 (0.62) ALDH1A1TSHRCYP1A2PPARGL3MBTL1
SCHEMBL284377 0.82 ALDH1A1 (0.62) ALDH1A1TSHRCYP1A2PPARGL3MBTL1
SCHEMBL1094586 0.82 ALDH1A1 (0.62) ALDH1A1TSHRCYP1A2PPARGL3MBTL1
SCHEMBL4612541 0.82 ALDH1A1 (0.62) ALDH1A1TSHRCYP1A2PPARGL3MBTL1
SCHEMBL21722823 0.82 ALDH1A1 (0.62) ALDH1A1TSHRCYP1A2PPARGL3MBTL1
SCHEMBL21722512 0.82 ALDH1A1 (0.62) ALDH1A1TSHRCYP1A2PPARGL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0722960-B1 Copolymers for preparing cast glass, or molding materials for preparing heat stable shaped articles AGOMER GES MIT BESCHRAENKTER H (DE) 1999-06-02 EP disclosed
US-5880235-A POLYMER PREPARED BY COPOLYMERIZING ALPHA-METHYLENE-GAMMA-BUTYROLACTONE AND VINYLICALLY UNSATURATED MONOMER AGOMER GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1999-03-09 US disclosed
EP-0722960-A2 Copolymers for preparing cast glass, or molding materials for preparing heat stable shaped articles Degussa Aktiengesellschaft (DE) 1996-07-24 EP disclosed