SCHEMBL4369869

SCHEMBL4369869

COC(=O)c1sc2ncnc(Oc3c(C)noc3C)c2c1C

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.52
HPGD P15428 2/20 0.48
ATM Q13315 1/20 0.44
MKNK2 Q9HBH9 9/20 0.43
KDM4E B2RXH2 2/20 0.41
MKNK1 Q9BUB5 1/20 0.40
ALDH1A1 P00352 2/20 0.39
MAPT P10636 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
TSHR P16473 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
POLB P06746 2/20 0.38
RECQL P46063 1/20 0.38
TDP1 Q9NUW8 1/20 0.38

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
SCHEMBL3982105 0.89 HSD17B10 (0.46) HSD17B10HPGDMKNK2KDM4EMKNK1
SCHEMBL3980765 0.77 MRGPRX1 (0.64) HSD17B10HPGDATMMKNK2MKNK1
SCHEMBL2368112 0.72 HPGD (0.57) HSD17B10HPGDATMMKNK2KDM4E
SCHEMBL4365183 0.70 MRGPRX1 (0.51) HSD17B10HPGDATMMKNK2MKNK1
SCHEMBL4902745 0.70 KDR (0.57) HSD17B10HPGDMKNK2MKNK1
SCHEMBL3979886 0.69 MRGPRX1 (0.49) HSD17B10HPGDMKNK2MKNK1ALDH1A1
SCHEMBL23630827 0.69 HSD17B10 (1.00) HSD17B10HPGDKDM4EALDH1A1MAPT
SCHEMBL4081930 0.66 ALDH1A1 (0.57) HSD17B10HPGDKDM4EALDH1A1SMN1; SMN2
SCHEMBL3977843 0.66 HSD17B10 (0.48) HSD17B10HPGDATMMKNK2KDM4E
SCHEMBL8241663 0.66 HSD17B10 (0.56) HSD17B10HPGDATMMKNK2KDM4E

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
US-20090291971-A1 HETEROARYL ETHERS AND PROCESSES FOR THEIR PREPARATION WYETH (US) 2009-11-26 US disclosed
US-20090291971-A1 HETEROARYL ETHERS AND PROCESSES FOR THEIR PREPARATION WYETH (US) 2009-11-26 US disclosed
US-20090291971-A1 HETEROARYL ETHERS AND PROCESSES FOR THEIR PREPARATION WYETH (US) 2009-11-26 US 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 (1 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-20090291971-A1 HETEROARYL ETHERS AND PROCESSES FOR THEIR PREPARATION AHR, MALT1, ABL1 HSD17B10 1698/4885HPGD 1495/4885ATM 2998/4885

“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.