SCHEMBL10513465

SCHEMBL10513465

C=CCOC(=O)Oc1ccc(Br)c(Br)c1Br

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.40
TSHR P16473 4/20 0.36
GAA P10253 1/20 0.36
ALDH1A1 P00352 4/20 0.36
HSD17B10 Q99714 3/20 0.36
PTP4A3 O75365 2/20 0.35
PTP4A1 Q93096 2/20 0.35
POLB P06746 1/20 0.34
MAPK1 P28482 1/20 0.34
LIG1 P18858 1/20 0.34
NPSR1 Q6W5P4 1/20 0.33
PTP4A2 Q12974 1/20 0.33
HPGD P15428 3/20 0.33
KDM4E B2RXH2 3/20 0.33
TP53 P04637 1/20 0.33
PKM P14618 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
SNCA P37840 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL10513877 0.86 CYP3A4 (0.42) CYP3A4TSHRGAAALDH1A1HSD17B10
SCHEMBL9174748 0.79 CYP3A4 (0.49) CYP3A4TSHRGAAALDH1A1HSD17B10
SCHEMBL270238 0.79 NCEH1 (0.38) CYP3A4ALDH1A1HPGDPKMSMN1; SMN2
SCHEMBL6153776 0.76 CYP3A4 (0.56) CYP3A4TSHRGAAALDH1A1HSD17B10
SCHEMBL331642 0.75 TYMS (0.42) CYP3A4TSHRGAAHPGDPKM
SCHEMBL30596831 0.75 TYMS (0.42) CYP3A4TSHRGAAHPGDPKM
SCHEMBL25661 0.74 HPGD (0.45) CYP3A4TSHRGAAALDH1A1HSD17B10
SCHEMBL10871081 0.72 CYP3A4 (0.47) CYP3A4TSHRGAAALDH1A1HSD17B10
SCHEMBL9174753 0.72 CYP3A4 (0.43) CYP3A4TSHRALDH1A1HSD17B10POLB
SCHEMBL6241641 0.72 CYP3A4 (0.51) CYP3A4TSHRGAAALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113736202-B Preparation method of nanoscale high-dispersion low-smoke flame-retardant high-impact polystyrene 上海葛蓝化工科技有限公司 2023-07-28 CN claimed
CN-113956599-A Low-smoke high-flame-retardant high-impact polystyrene resin 兰州石化职业技术学院 2022-01-21 CN claimed
CN-113897017-A High-flame-retardant high-impact polystyrene resin 兰州石化职业技术学院 2022-01-07 CN claimed
CN-113736202-A Preparation method of nano-scale high-dispersion low-smoke flame-retardant high-impact polystyrene 上海葛蓝化工科技有限公司 2021-12-03 CN claimed
EP-0320954-A2 Transparent resin and transparent resin products NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1989-06-21 EP claimed
CN-113736202-B Preparation method of nanoscale high-dispersion low-smoke flame-retardant high-impact polystyrene 上海葛蓝化工科技有限公司 2023-07-28 CN disclosed
CN-113956599-A Low-smoke high-flame-retardant high-impact polystyrene resin 兰州石化职业技术学院 2022-01-21 CN disclosed
CN-113897017-A High-flame-retardant high-impact polystyrene resin 兰州石化职业技术学院 2022-01-07 CN disclosed
CN-113736202-A Preparation method of nano-scale high-dispersion low-smoke flame-retardant high-impact polystyrene 上海葛蓝化工科技有限公司 2021-12-03 CN disclosed
EP-0320954-A2 Transparent resin and transparent resin products NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1989-06-21 EP disclosed