SCHEMBL8965576

SCHEMBL8965576

C=CC(=O)OCCCC(O)OC(=O)C=C

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.59
ALDH1A1 P00352 4/20 0.59
CYP3A4 P08684 2/20 0.59
HPGD P15428 1/20 0.53
TP53 P04637 3/20 0.48
HIF1A Q16665 3/20 0.48
HSD17B10 Q99714 1/20 0.48
MAPK1 P28482 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
THRB P10828 2/20 0.38
ATM Q13315 1/20 0.34
HCAR2 Q8TDS4 2/20 0.31

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
SCHEMBL2284196 0.89 TSHR (0.52) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL11233280 0.86 TSHR (0.41) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL9329300 0.85 TSHR (0.69) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL4928231 0.82 TSHR (0.65) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL28863909 0.81 TSHR (0.38) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL27970320 0.81 TSHR (0.63) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL211671 0.81 TSHR (0.42) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL8565036 0.80 TSHR (0.57) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL31008862 0.80 TSHR (0.57) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL28209869 0.80 TSHR (0.71) TSHRALDH1A1CYP3A4HPGDTP53

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
CN-110116567-B Transfer UV printing onto curved surfaces with stretchable UV inks 施乐公司 2022-06-17 CN disclosed
US-5547762-A THERMOSETTING RESIN LAYER BRIDGESTONE CORPORATION (JP) 1996-08-20 US disclosed