SCHEMBL6143587

SCHEMBL6143587

Cc1snc(-c2ccc(Cl)cc2)c1C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 12/20 0.47
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2C8 P10632 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2A6 P11509 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
FFAR4 Q5NUL3 1/20 0.45
PTGDR2 Q9Y5Y4 1/20 0.44
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
KDM4E B2RXH2 1/20 0.44
POLB P06746 1/20 0.44
GRM5 P41594 1/20 0.44
GRM1 Q13255 1/20 0.44
BACE1 P56817 1/20 0.43
CDH1 P12830 1/20 0.41
APC P25054 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
SCHEMBL12691935 0.87 KDR (0.49) DHODHRAB9ASMN1; SMN2KDM4EPOLB
SCHEMBL3294243 0.85 DHODH (0.43) DHODHFFAR4GRM1BACE1MEN1
SCHEMBL11789345 0.85 PDE10A (0.49) DHODHCYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL2339243 0.82 KDM4E (0.45) DHODHCYP1A2CYP3A4CYP2C8CYP2D6
SCHEMBL899644 0.81 BACE1 (0.52) SMN1; SMN2KDM4EPOLBGRM5GRM1
SCHEMBL3400194 0.81 PRKCZ (0.52) DHODHNPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL14710197 0.79 DGAT1 (0.51) PTGDR2POLBBACE1LMNA
SCHEMBL2346052 0.78 DHODH (0.46) DHODHCYP1A2CYP3A4CYP2C8CYP2C9
SCHEMBL19643463 0.77 FFAR4 (0.49) DHODHCYP1A2CYP3A4CYP2C8CYP2D6
SCHEMBL11790564 0.76 ALDH1A1 (0.47) DHODHKDM4EPOLBLMNAKMT2A

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-1194414-B1 PROCESS FOR PREPARING 2-AMINO-4-(4-FLUORPHENYL)-6-ALKYLPYRIMIDINE-5-CARBOXYLATE LONZA AG (CH) 2005-10-19 EP disclosed