SCHEMBL9208681

SCHEMBL9208681

O=C(Nc1nnc(S)s1)c1c(O)c2ccccc2oc1=O

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 1/20 0.50
▸ CA9 Q16790 1/20 0.50
▸ NPC1 O15118 5/20 0.49
▸ RAB9A P51151 4/20 0.49
▸ POLB P06746 1/20 0.49
▸ LMNA P02545 3/20 0.45
▸ HPGD P15428 1/20 0.45
▸ ALDH1A1 P00352 2/20 0.44
▸ MAPT P10636 3/20 0.44
▸ KDM4E B2RXH2 2/20 0.44
▸ SMN1; SMN2 Q16637 2/20 0.44
▸ HTT P42858 4/20 0.44
▸ NQO1 P15559 1/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42
▸ KMT2A Q03164 2/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ TP53 P04637 1/20 0.41
▸ CRHBP P24387 1/20 0.41
▸ CRHR2 Q13324 1/20 0.41

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
SCHEMBL7640498 0.87 CA12 (0.51) CA12CA9NPC1RAB9APOLB
SCHEMBL9202732 0.87 CA12 (0.51) CA12CA9NPC1RAB9APOLB
SCHEMBL9205774 0.85 RAB9A (0.53) CA12CA9NPC1RAB9APOLB
SCHEMBL9205672 0.83 RAB9A (0.53) CA12CA9NPC1RAB9APOLB
SCHEMBL9203908 0.83 MAPT (0.62) CA12CA9NPC1RAB9APOLB
SCHEMBL9208153 0.83 NPC1 (0.64) CA12CA9NPC1RAB9APOLB
SCHEMBL9207001 0.82 NPC1 (0.56) CA12CA9NPC1RAB9APOLB
SCHEMBL9203435 0.82 NPC1 (0.59) NPC1RAB9APOLBLMNAALDH1A1
SCHEMBL9207392 0.81 NPC1 (0.53) CA12CA9NPC1RAB9APOLB
SCHEMBL9207577 0.80 CA12 (0.51) CA12CA9LMNAHPGDALDH1A1

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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