SCHEMBL20534906

SCHEMBL20534906

O=C(O)COCCOCCOCCOCCOCCOCC(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.46
BLM P54132 1/20 0.46
PMP22 Q01453 1/20 0.46
TSHR P16473 4/20 0.45
CTH P32929 1/20 0.45
CBS P35520 1/20 0.45
THPO P40225 1/20 0.45
THRB P10828 1/20 0.43
KMT2A Q03164 2/20 0.37
MEN1 O00255 1/20 0.37
ALDH1A1 P00352 3/20 0.36
TP53 P04637 2/20 0.36
HIF1A Q16665 2/20 0.36
EPHX2 P34913 1/20 0.35
ALOX15 P16050 1/20 0.35
PTGS1 P23219 1/20 0.34
CYP2C19 P33261 1/20 0.34
LDHA P00338 1/20 0.33
SRR Q9GZT4 1/20 0.33
LMNA P02545 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
SCHEMBL81956 1.00 HSD17B10 (0.46) HSD17B10BLMPMP22TSHRCTH
SCHEMBL14950228 1.00 HSD17B10 (0.46) HSD17B10BLMPMP22TSHRCTH
SCHEMBL25495618 1.00 HSD17B10 (0.46) HSD17B10BLMPMP22TSHRCTH
SCHEMBL6666413 1.00 HSD17B10 (0.46) HSD17B10BLMPMP22TSHRCTH
SCHEMBL6664456 1.00 HSD17B10 (0.46) HSD17B10BLMPMP22TSHRCTH
Hydrochloric Acid SCHEMBL8451150 0.97 THRB (0.48) HSD17B10BLMPMP22TSHRCTH
SCHEMBL1277996 0.97 HSD17B10 (0.44) HSD17B10BLMPMP22TSHRCTH
SCHEMBL3796484 0.97 HSD17B10 (0.44) HSD17B10BLMPMP22TSHRCTH
SCHEMBL45305 0.97 TSHR (0.47) HSD17B10BLMPMP22TSHRCTH
SCHEMBL25377946 0.93 TSHR (0.45) HSD17B10BLMPMP22TSHRCTH

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-117822319-A Flame-retardant nylon yarn and preparation process thereof 江苏九州纺织有限公司 2024-04-05 CN disclosed
CN-110573507-B Small molecules 邓迪大学 2023-11-14 CN disclosed
EP-3609889-B1 SMALL MOLECULES UNIV DUNDEE (GB) 2023-07-05 EP disclosed
US-20220127257-A1 SMALL MOLECULES UNIVERSITY OF DUNDEE (GB) 2022-04-28 US disclosed
US-11261179-B2 Small molecules UNIVERSITY OF DUNDEE (GB) 2022-03-01 US disclosed
US-20210163469-A1 SMALL MOLECULES UNIVERSITY OF DUNDEE (GB) 2021-06-03 US disclosed
EP-3727355-A1 COMPOUNDS AND THEIR USE IN TREATING CANCER AstraZeneca AB (SE) 2020-10-28 EP disclosed
EP-3609889-A1 SMALL MOLECULES University Of Dundee (GB) 2020-02-19 EP disclosed
US-20190194190-A1 Compounds and Their Use in Treating Cancer ASTRAZENECA PHARMACEUTICALS LP 2019-06-27 US disclosed
WO-2018189554-A1 SMALL MOLECULES UNIVERSITY OF DUNDEE (GB) 2018-10-18 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20220127257-A1 SMALL MOLECULES ADRM1, MDM2, UBE2B HSD17B10 1202/4885BLM 1244/4885PMP22 3656/4885
US-11261179-B2 Small molecules ADRM1, MDM2, UBE2B HSD17B10 1202/4885BLM 1244/4885PMP22 3656/4885
US-20190194190-A1 Compounds and Their Use in Treating Cancer F12, CCNY, CCNE1 HSD17B10 2674/4885BLM 971/4885PMP22 3879/4885
US-20210163469-A1 SMALL MOLECULES ADRM1, MDM2, UBE2B HSD17B10 1202/4885BLM 1244/4885PMP22 3656/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.