SCHEMBL5488026

SCHEMBL5488026

CC(=O)Oc1c(C(N)=O)ncc2sc(-c3ccc(Oc4ccccc4)cc3)cc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 1/20 0.42
ICAM1 P05362 2/20 0.40
SELE P16581 2/20 0.40
PTPN1 P18031 1/20 0.38
PTPRA P18433 1/20 0.38
CHEK2 O96017 1/20 0.37
SCN9A Q15858 2/20 0.37
MAP3K8 P41279 2/20 0.37
CCNC P24863 1/20 0.37
CDK8 P49336 1/20 0.37
MAP2K1 Q02750 1/20 0.37
ADORA2A P29274 1/20 0.37
LRRK2 Q5S007 1/20 0.37
MAPT P10636 2/20 0.36
S1PR1 P21453 1/20 0.36
KDM4E B2RXH2 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
VCAM1 P19320 1/20 0.36
BACE1 P56817 2/20 0.36
TDP1 Q9NUW8 1/20 0.36

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
SCHEMBL1116031 0.78 EGLN1 (0.50) LRRK2
SCHEMBL5488037 0.74 EGLN2 (0.45) CHEK1ICAM1SELEPTPN1PTPRA
SCHEMBL1973999 0.71 MAPT (0.42) SCN9AMAPTKDM4ESMN1; SMN2TDP1
SCHEMBL27755823 0.71 ADORA2A (0.40) ADORA2AMAPTKDM4ESMN1; SMN2BACE1
SCHEMBL967020 0.71 EGLN1 (0.65)
SCHEMBL21670013 0.70 EGLN1 (0.52) CHEK2SCN9AADORA2ALRRK2MAPT
SCHEMBL28570242 0.69 THRA (0.52) CHEK2SCN9AADORA2ALRRK2KDM4E
SCHEMBL28556240 0.69 THRA (0.51) CHEK2SCN9AADORA2ALRRK2MAPT
SCHEMBL27861661 0.67 PARP10 (0.41) ICAM1SELEADORA2AVCAM1PARP10
SCHEMBL28993794 0.67 EGLN2 (0.50) LRRK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070292433-A1 Compounds and methods for treatment of chemotherapy-induced anemia FIBROGEN, INC. (US) 2007-12-20 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-20070292433-A1 Compounds and methods for treatment of chemotherapy-induced anemia EPOR, MCL1, HIF1AN CHEK1 1795/4885ICAM1 3047/4885SELE 165/4885

“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.