SCHEMBL18864233

SCHEMBL18864233

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

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.41
▸ NOTUM Q6P988 1/20 0.33
▸ DDR1 Q08345 10/20 0.33
▸ SMN1; SMN2 Q16637 2/20 0.32
▸ HPGD P15428 1/20 0.32
▸ LRRK2 Q5S007 1/20 0.31
▸ NR3C1 P04150 1/20 0.30
▸ NPC1 O15118 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ RAB9A P51151 1/20 0.30
▸ L3MBTL1 Q9Y468 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
SCHEMBL18854938 0.90 NOTUM (0.36) NOTUM
SCHEMBL18866338 0.88 POLB (0.40) POLBDDR1SMN1; SMN2HPGDLRRK2
SCHEMBL18866373 0.87 POLB (0.40) POLBDDR1
SCHEMBL18866479 0.86 POLB (0.39) POLBDDR1
SCHEMBL18864234 0.85 POLB (0.39) POLBDDR1
SCHEMBL18866478 0.85 POLB (0.39) POLBDDR1
SCHEMBL18866471 0.85 POLB (0.39) POLBDDR1
SCHEMBL18866410 0.85 POLB (0.38) POLBDDR1
SCHEMBL18923941 0.85 POLB (0.38) POLBDDR1
SCHEMBL31141500 0.84 POLB (0.46) POLBDDR1LRRK2MAPTL3MBTL1

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 POLB 4756/4885NOTUM 241/4885DDR1 4530/4885

“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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