SCHEMBL8398071

SCHEMBL8398071

C=C1OC(=O)CC1CCCC

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.43
TSHR P16473 1/20 0.43
CYP1A2 P05177 3/20 0.39
TP53 P04637 1/20 0.36
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
HTT P42858 1/20 0.34
TYR P14679 1/20 0.33
PPARG P37231 1/20 0.32
NOS3 P29474 1/20 0.32
NOS1 P29475 1/20 0.32
NOS2 P35228 1/20 0.32
CYP2C9 P11712 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
KDM4E B2RXH2 1/20 0.31
MAPT P10636 1/20 0.31
PKM P14618 1/20 0.31
HPGD P15428 1/20 0.31
PRKCA P17252 1/20 0.30
POLB P06746 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
SCHEMBL8397498 0.95 ALDH1A1 (0.45) ALDH1A1TSHRCYP1A2HTTTYR
SCHEMBL8398652 0.93 ALDH1A1 (0.48) ALDH1A1TSHRCYP1A2HTTTYR
SCHEMBL8398416 0.89 ALDH1A1 (0.38) ALDH1A1TSHRCYP1A2
SCHEMBL819901 0.81 ALDH1A1 (0.57) ALDH1A1TSHRCYP1A2TP53MEN1
SCHEMBL15095430 0.81 ALDH1A1 (0.57) ALDH1A1TSHRCYP1A2TP53MEN1
SCHEMBL8398145 0.80
SCHEMBL11758645 0.79 ALDH1A1 (0.44) ALDH1A1TSHRCYP1A2TP53MEN1
SCHEMBL26046111 0.78 ALDH1A1 (0.31) ALDH1A1TSHR
SCHEMBL8633248 0.76 ALDH1A1 (0.60) ALDH1A1TSHRCYP1A2HTTPPARG
SCHEMBL4564876 0.76 ALDH1A1 (0.59) ALDH1A1TSHRCYP1A2HTTPPARG

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