SCHEMBL3980765

SCHEMBL3980765

COC(=O)c1sc2ncnc(Oc3ccccc3)c2c1C

nearest known ligand 0.64

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MRGPRX1 Q96LB2 7/20 0.64
HSD17B10 Q99714 1/20 0.56
HPGD P15428 1/20 0.52
MKNK2 Q9HBH9 6/20 0.51
ATM Q13315 1/20 0.47
MAPT P10636 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
TDP1 Q9NUW8 1/20 0.46
MKNK1 Q9BUB5 1/20 0.45
KDR P35968 1/20 0.44

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
SCHEMBL4365183 0.85 MRGPRX1 (0.51) MRGPRX1HSD17B10HPGDMKNK2ATM
SCHEMBL3979886 0.83 MRGPRX1 (0.49) MRGPRX1HSD17B10HPGDMKNK2MAPT
SCHEMBL4369869 0.77 HSD17B10 (0.52) HSD17B10HPGDMKNK2ATMMAPT
SCHEMBL3977843 0.76 HSD17B10 (0.48) HSD17B10HPGDMKNK2ATMMAPT
SCHEMBL2368112 0.75 HPGD (0.57) HSD17B10HPGDMKNK2ATMMAPT
SCHEMBL13844360 0.74 HSD17B10 (0.47) MRGPRX1HSD17B10HPGDMKNK2ATM
SCHEMBL15426163 0.74 FGFR1 (0.67) MKNK2MKNK1
SCHEMBL4902745 0.73 KDR (0.57) HSD17B10HPGDMKNK2MKNK1KDR
SCHEMBL4902721 0.72 SHMT2 (0.77) HPGDMKNK2MAPTSMN1; SMN2MKNK1
SCHEMBL23630827 0.72 HSD17B10 (1.00) HSD17B10HPGDMAPTSMN1; SMN2NPSR1

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 5 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
WO-2009058937-A2 HETEROARYL ETHERS AND PROCESSES FOR THEIR PREPARATION WYETH (US) 2009-05-07 WO disclosed
WO-2009058937-A2 HETEROARYL ETHERS AND PROCESSES FOR THEIR PREPARATION WYETH (US) 2009-05-07 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 (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 MRGPRX1 2655/4885HSD17B10 1698/4885HPGD 1495/4885

“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.