SCHEMBL9530740

SCHEMBL9530740

O=C(c1ccccc1)c1ccc(NC(=O)c2c(O)c3ccccc3oc2=O)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.53
CA9 Q16790 1/20 0.53
NPC1 O15118 2/20 0.52
KMT2A Q03164 2/20 0.52
MEN1 O00255 1/20 0.52
RAB9A P51151 1/20 0.52
FFAR1 O14842 1/20 0.49
LMNA P02545 3/20 0.48
HPGD P15428 2/20 0.48
MAOB P27338 3/20 0.47
MAOA P21397 2/20 0.47
ALDH1A1 P00352 3/20 0.47
KDM4E B2RXH2 3/20 0.47
MAPT P10636 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
HTT P42858 3/20 0.46
POLB P06746 1/20 0.46
GFER P55789 1/20 0.46
CCNT1 O60563 1/20 0.46
CDK9 P50750 1/20 0.46

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
SCHEMBL7616879 0.90 CA12 (0.61) CA12CA9KMT2AMEN1LMNA
SCHEMBL7617329 0.86 MAOB (0.48) NPC1KMT2AMEN1RAB9AFFAR1
SCHEMBL9208802 0.85 NQO1 (0.59) CA12CA9NPC1KMT2AMEN1
SCHEMBL9207833 0.85 CA12 (0.56) CA12CA9KMT2ALMNAHPGD
SCHEMBL7615738 0.85 MAOB (0.56) CA12CA9NPC1KMT2AMEN1
SCHEMBL10613511 0.84 CA12 (0.69) CA12CA9KMT2AMEN1LMNA
SCHEMBL9528715 0.83 CA12 (0.51) CA12CA9KMT2AMEN1LMNA
SCHEMBL8441752 0.81 VKORC1 (0.58) CA12CA9NPC1KMT2AMEN1
SCHEMBL9209186 0.80 HIF1A (0.54) CA12CA9NPC1KMT2AMEN1
SCHEMBL9199986 0.79 CA12 (0.58) CA12CA9KMT2AMEN1LMNA

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

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