SCHEMBL9202075

SCHEMBL9202075

O=C(Nc1ccc(F)cc1)c1c(O)c2ccc(F)cc2oc1=O

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ NQO1 P15559 2/20 0.53
▸ MAOB P27338 3/20 0.50
▸ MAOA P21397 1/20 0.50
▸ NPC1 O15118 5/20 0.47
▸ RAB9A P51151 5/20 0.47
▸ CTDSP1 Q9GZU7 2/20 0.47
▸ TDP1 Q9NUW8 1/20 0.47
▸ SNCA P37840 2/20 0.45
▸ MEN1 O00255 4/20 0.44
▸ KMT2A Q03164 4/20 0.44
▸ AKR1C3 P42330 1/20 0.44
▸ CA12 O43570 2/20 0.42
▸ CA9 Q16790 2/20 0.42
▸ GBA1 P04062 1/20 0.42
▸ POLB P06746 1/20 0.42
▸ MAP1LC3B Q9GZQ8 1/20 0.41
▸ MAP1LC3A Q9H492 1/20 0.41
▸ CYP1A2 P05177 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40

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
SCHEMBL9207067 0.93 NQO1 (0.49) NQO1MAOBMAOANPC1RAB9A
SCHEMBL9203879 0.93 NQO1 (0.49) NQO1MAOBMAOANPC1RAB9A
SCHEMBL9201369 0.90 CA12 (0.47) NQO1MAOBMAOANPC1RAB9A
SCHEMBL9208185 0.90 P2RX1 (0.51) NQO1MAOBMAOANPC1RAB9A
SCHEMBL9207126 0.88 MAOB (0.47) NQO1MAOBMAOANPC1RAB9A
SCHEMBL7615738 0.87 MAOB (0.56) MAOBMAOANPC1RAB9AMEN1
SCHEMBL9200984 0.82 MAOB (0.48) NQO1MAOBMAOANPC1RAB9A
SCHEMBL9204225 0.82 CA12 (0.51) MAOBNPC1RAB9AMEN1KMT2A
SCHEMBL2761615 0.80 NQO1 (0.54) NQO1
SCHEMBL9209466 0.79 MAOB (0.60) MAOBNPC1RAB9ATDP1MEN1

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-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
EP-0550493-B1 ANTHELMINTIC AND ANTICOCCIDAL 3-CARBAMOYL-4-HYDROXYCOUMARINS, METHOD OF USE AND COMPOSITIONS UPJOHN CO (US) 1995-08-09 — — EP disclosed
Send feedback