SCHEMBL7464622

SCHEMBL7464622

CC(C(=O)O)c1oc(-n2ccnc2)nc1-c1ccc(Cl)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.39
ADRA1A P35348 1/20 0.39
NOTUM Q6P988 1/20 0.39
ADH5 P11766 5/20 0.39
CD38 P28907 1/20 0.38
IDO1 P14902 1/20 0.34
PORCN Q9H237 2/20 0.34
CYP27B1 O15528 2/20 0.34
CYP24A1 Q07973 2/20 0.34
CNR1 P21554 1/20 0.34
CNR2 P34972 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
MEN1 O00255 1/20 0.33
USP2 O75604 1/20 0.33
LMNA P02545 1/20 0.33
KMT2A Q03164 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33

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
SCHEMBL7468394 0.80 MAOA (0.42) MAOAADRA1ANOTUMCNR1CNR2
SCHEMBL7461994 0.80 ALDH1A1 (0.42) MAOAADRA1ASMN1; SMN2LMNACYP3A4
SCHEMBL6606357 0.79 MAOA (0.39) MAOAADRA1A
SCHEMBL7462934 0.78 MAOA (0.38) MAOAADRA1ACNR1SMN1; SMN2CYP2D6
SCHEMBL7466867 0.78 MAOA (0.41) MAOAADRA1ACNR1TDP1
SCHEMBL7456593 0.77 CNR1 (0.42) MAOAADRA1ACNR1NPSR1TDP1
SCHEMBL7463542 0.77 MAOA (0.39) MAOAADRA1ASMN1; SMN2LMNACYP3A4
SCHEMBL7459960 0.77 MAOA (0.48) MAOAADRA1ACYP3A4CYP2D6
SCHEMBL7468230 0.77 MAOA (0.37) MAOAADRA1ANPSR1
SCHEMBL7453586 0.77 MAPT (0.38) MAOAADRA1ACNR1SMN1; SMN2MEN1

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
US-6498179-B1 SUCH AS 4-(4-CHLOROPHENYL)-5-(3-(2-METHOXYPHENOXY)PROPYL)-2-(2-METHYL-1 -IMIDAZOLYL)OXAZOLE; INSULIN SECERTION PROMOTING AND BLOOD SUGAR DEPRESSING EFFECT; DIABETES; LOW TOXICITY TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2002-12-24 US disclosed
EP-0891340-B1 OXAZOLE DERIVATIVES, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2002-11-13 EP disclosed
US-6177452-B1 ANTIDIABETIC AGENTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-01-23 US disclosed