SCHEMBL9985390

SCHEMBL9985390

O=c1oc(-c2ccccc2Cl)nc2c(Cl)cccc12

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ C1R P00736 6/20 0.70
▸ ELANE P08246 5/20 0.60
▸ KMT2A Q03164 2/20 0.56
▸ MEN1 O00255 1/20 0.56
▸ MAPT P10636 1/20 0.56
▸ HTT P42858 1/20 0.56
▸ KLK7 P49862 3/20 0.54
▸ KLK14 Q9P0G3 3/20 0.54
▸ KLK5 Q9Y337 3/20 0.54
▸ CTSG P08311 2/20 0.54
▸ PRSS1 P07477 2/20 0.54
▸ NPC1 O15118 1/20 0.47
▸ TP53 P04637 1/20 0.47
▸ HPGD P15428 1/20 0.47
▸ RAB9A P51151 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ F2 P00734 1/20 0.47
▸ PLG P00747 1/20 0.47
▸ KLK1 P06870 1/20 0.47
▸ C1S P09871 1/20 0.47

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
SCHEMBL5257723 0.91 C1R (0.58) C1RELANEKMT2AMEN1MAPT
SCHEMBL9985296 0.88 ELANE (0.64) C1RELANEKMT2AMEN1MAPT
SCHEMBL25054223 0.88 C1R (0.63) C1RELANEKMT2AMEN1MAPT
SCHEMBL9984176 0.88 ELANE (0.64) C1RELANEKMT2AMEN1MAPT
SCHEMBL9985005 0.88 ELANE (0.64) C1RELANEKMT2AMEN1MAPT
SCHEMBL9984385 0.85 ELANE (0.66) C1RELANEKMT2AMEN1MAPT
SCHEMBL5921483 0.83 ELANE (0.51) C1RELANEKMT2AMEN1MAPT
SCHEMBL5780185 0.83 C1R (1.00) C1RELANEKMT2AMEN1MAPT
SCHEMBL914419 0.76 C1R (0.70) C1RELANEKMT2AMEN1MAPT
SCHEMBL4116511 0.76 ELANE (0.70) C1RELANEKMT2AMEN1PARP1

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-20110319611-A1 BENZOXAZINONE COMPOUND, METHOD FOR PRODUCING THE SAME, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME CHANG GUNG UNIVERSITY (TW) 2011-12-29 — — 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-20110319611-A1 BENZOXAZINONE COMPOUND, METHOD FOR PRODUCING THE SAME, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME CYP4X1, CYP2B6, CYP2C19 C1R 84/4885ELANE 3461/4885KMT2A 2397/4885

“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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