SCHEMBL18854937

SCHEMBL18854937

CCS(=O)(=O)c1ccc(-n2cnc(N)n2)nc1-c1nc2cc(C)cnc2n1C

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ HSP90AA1 P07900 1/20 0.31
▸ HSP90AB1 P08238 1/20 0.31
▸ AKT1 P31749 1/20 0.30
▸ AKT2 P31751 1/20 0.30
▸ BRD4 O60885 1/20 0.30

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
SCHEMBL18854930 0.90 LMNA (0.32) BRD4
SCHEMBL18854928 0.89 BRD4 (0.32) BRD4
SCHEMBL18854929 0.89 BRD4 (0.30) BRD4
SCHEMBL18866471 0.88 POLB (0.39) —
SCHEMBL18854934 0.88 — —
SCHEMBL18854932 0.88 DDR1 (0.30) —
SCHEMBL18854935 0.87 — —
SCHEMBL18854931 0.86 DDR1 (0.34) —
SCHEMBL18854939 0.86 CTSL (0.30) —
SCHEMBL18854936 0.85 LMNA (0.30) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9668482-B1 Fused heterocyclic compound and pest control application thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-06-06 — — US disclosed
US-20170135348-A1 FUSED HETEROCYCLIC COMPOUND AND PEST CONTROL APPLICATION THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-05-18 — — 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-20170135348-A1 FUSED HETEROCYCLIC COMPOUND AND PEST CONTROL APPLICATION THEREOF KEAP1, DDT, CYP4B1 HSP90AA1 1854/4885HSP90AB1 2232/4885AKT1 1631/4885

“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.

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