SCHEMBL9206802

SCHEMBL9206802

O=C(Nc1ccc(Cl)nc1)c1c(O)c2ccc(Cl)cc2oc1=O

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ KCNQ3 O43525 18/20 0.50
▸ KCNQ2 O43526 18/20 0.50
▸ KCNE1 P15382 14/20 0.50
▸ KCNQ1 P51787 14/20 0.50
▸ BACE1 P56817 1/20 0.43
▸ F10 P00742 1/20 0.40
▸ NT5E P21589 1/20 0.39

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
SCHEMBL9200984 0.87 MAOB (0.48) NT5E
SCHEMBL9208790 0.86 KCNQ3 (0.56) KCNQ3KCNQ2KCNE1KCNQ1BACE1
SCHEMBL9202301 0.86 KMT2A (0.51) —
SCHEMBL9202749 0.86 KCNQ3 (0.52) KCNQ3KCNQ2KCNE1KCNQ1BACE1
SCHEMBL9208185 0.85 P2RX1 (0.51) NT5E
SCHEMBL9199959 0.83 CA1 (0.47) NT5E
SCHEMBL9202276 0.82 ALDH1A1 (0.54) —
SCHEMBL9203879 0.81 NQO1 (0.49) NT5E
SCHEMBL8441905 0.80 P2RX1 (0.54) NT5E
SCHEMBL7617329 0.79 MAOB (0.48) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0550493-B1 ANTHELMINTIC AND ANTICOCCIDAL 3-CARBAMOYL-4-HYDROXYCOUMARINS, METHOD OF USE AND COMPOSITIONS UPJOHN CO (US) 1995-08-09 — — EP claimed
EP-0550493-A1 ANTHELMINTIC AND ANTICOCCIDAL 3-CARBAMOYL-4-HYDROXYCOUMARINS, METHOD OF USE AND COMPOSITIONS. UPJOHN CO (US) 1993-07-14 — — EP claimed
WO-1992006083-A1 ANTHELMINTIC AND ANTICOCCIDAL 3-CARBAMOYL-4-HYDROXYCOUMARINS, METHOD OF USE AND COMPOSITIONS THE UPJOHN COMPANY (US) 1992-04-16 — — WO claimed
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