SCHEMBL8087663

SCHEMBL8087663

CCCOC(=O)C(C)=CN(CCC)CCC

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.36
TSHR P16473 3/20 0.34
ALDH1A1 P00352 3/20 0.32
GAA P10253 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
THRB P10828 1/20 0.32
LMNA P02545 1/20 0.31
POLB P06746 1/20 0.31
ATM Q13315 1/20 0.31
KDM4E B2RXH2 1/20 0.30
GLA P06280 1/20 0.30
ESR1 P03372 1/20 0.30
CHRM1 P11229 1/20 0.30
SLC6A2 P23975 1/20 0.30
KDR P35968 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL8515691 0.89 TSHR (0.40) HCAR2TSHRALDH1A1GAALMNA
SCHEMBL8081440 0.87 GLO1 (0.42) TSHRALDH1A1GAASMN1; SMN2LMNA
SCHEMBL516387 0.87 HCAR2 (0.37) HCAR2TSHRALDH1A1GAASMN1; SMN2
SCHEMBL28762869 0.86 TSHR (0.38) HCAR2TSHRALDH1A1ATM
SCHEMBL16868400 0.81 CYP2C9 (0.41) HCAR2TSHRALDH1A1GAASMN1; SMN2
SCHEMBL524762 0.81 CYP2C9 (0.41) HCAR2TSHRALDH1A1GAASMN1; SMN2
SCHEMBL9657319 0.81 HCAR2 (0.37) HCAR2TSHRTHRB
SCHEMBL29157017 0.80 GLO1 (0.40) TSHRALDH1A1SMN1; SMN2LMNA
SCHEMBL28283109 0.80 TSHR (0.53) HCAR2TSHRALDH1A1LMNAATM
Ammonia Solution, Strong SCHEMBL28001098 0.79 CYP2C9 (0.40) HCAR2TSHRALDH1A1GAASMN1; SMN2

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-0735426-B1 Radiation curable polymers and method of producing the same DAINIPPON INK & CHEMICALS (JP) 2000-10-11 EP disclosed
US-5847022-A Radiation curable resin composition and method therefor DAINIPPON INK AND CHEMICALS, INC. (JP) 1998-12-08 US disclosed
EP-0735426-A1 Radiation curable polymers and method of producing the same DAINIPPON INK AND CHEMICALS, INC. (JP) 1996-10-02 EP disclosed