SCHEMBL7616823

SCHEMBL7616823

O=C(Nc1nnc(C(F)F)s1)c1c(O)c2ccc(C(F)(F)F)cc2oc1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 5/20 0.41
▸ MAPT P10636 3/20 0.41
▸ HPGD P15428 5/20 0.39
▸ SMN1; SMN2 Q16637 4/20 0.39
▸ KDM4E B2RXH2 2/20 0.39
▸ POLB P06746 2/20 0.39
▸ MEN1 O00255 3/20 0.38
▸ CSNK2A2 P19784 1/20 0.37
▸ CSNK2B P67870 1/20 0.37
▸ CSNK2A1 P68400 1/20 0.37
▸ CSNK2A3 Q8NEV1 1/20 0.37
▸ NPC1 O15118 4/20 0.37
▸ RAB9A P51151 4/20 0.37
▸ HTT P42858 2/20 0.37
▸ ALDH1A1 P00352 3/20 0.36
▸ HSD17B10 Q99714 2/20 0.36
▸ TSHR P16473 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ LMNA P02545 2/20 0.36
▸ TDP1 Q9NUW8 1/20 0.35

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
SCHEMBL7620353 0.87 NQO1 (0.43) KMT2AMAPTHPGDSMN1; SMN2KDM4E
SCHEMBL7617104 0.87 KMT2A (0.53) KMT2AMAPTHPGDSMN1; SMN2KDM4E
SCHEMBL7610904 0.86 MAPT (0.40) KMT2AMAPTHPGDSMN1; SMN2KDM4E
SCHEMBL7617634 0.86 MAPT (0.51) KMT2AMAPTHPGDSMN1; SMN2KDM4E
SCHEMBL7620367 0.85 KMT2A (0.45) KMT2AMAPTHPGDSMN1; SMN2KDM4E
SCHEMBL7608938 0.85 KMT2A (0.45) KMT2AMAPTHPGDSMN1; SMN2KDM4E
SCHEMBL7615837 0.81 NQO1 (0.43) KMT2AMAPTSMN1; SMN2KDM4EMEN1
SCHEMBL7609210 0.80 NQO1 (0.42) KMT2AMAPTSMN1; SMN2POLBMEN1
SCHEMBL7610155 0.77 MEN1 (0.56) KMT2AMAPTHPGDSMN1; SMN2KDM4E
SCHEMBL9206228 0.77 POLB (0.53) KMT2AMAPTHPGDSMN1; SMN2KDM4E

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
EP-0869785-B1 4-HYDROXYCOUMARIN-3-CARBOXAMIDES FOR THE TREATMENT OF NON-INSULIN DEPENDENT DIABETES MELLITUS UPJOHN CO (US) 2002-08-28 — — EP claimed
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