SCHEMBL8879518

SCHEMBL8879518

C#CCOc1ccc(-c2nc(-c3ccccc3Cl)nn2C)c(Cl)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 11/20 0.41
MAOA P21397 8/20 0.41
L3MBTL1 Q9Y468 1/20 0.38
AOC3 Q16853 2/20 0.38
HSD11B1 P28845 2/20 0.38
CRHR1 P34998 2/20 0.37
GRM5 P41594 1/20 0.36
EGFR P00533 1/20 0.35
TUBB4A P04350 1/20 0.35
TUBB P07437 1/20 0.35
TUBA3C P0DPH7 1/20 0.35
TUBA1B P68363 1/20 0.35
TUBA4A P68366 1/20 0.35
TUBB4B P68371 1/20 0.35
TUBB3 Q13509 1/20 0.35
TUBB2A Q13885 1/20 0.35
TUBB8 Q3ZCM7 1/20 0.35
TUBA3E Q6PEY2 1/20 0.35
TUBA1A Q71U36 1/20 0.35
TUBA1C Q9BQE3 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
SCHEMBL8877368 0.85 PDE2A (0.44) L3MBTL1AOC3HSD11B1CRHR1EGFR
SCHEMBL8876335 0.84 PDE2A (0.40) L3MBTL1AOC3HSD11B1CRHR1EGFR
SCHEMBL8877623 0.83 ATM (0.47) MAOBL3MBTL1AOC3HSD11B1CRHR1
SCHEMBL8876330 0.80 ADORA2A (0.40) L3MBTL1HSD11B1CRHR1EGFRTUBB4A
SCHEMBL8304887 0.79 HSD11B1 (0.55) HSD11B1EGFRTUBB4ATUBBTUBA3C
SCHEMBL8876943 0.76 CRHR1 (0.43) L3MBTL1HSD11B1CRHR1EGFRTUBB4A
SCHEMBL8876361 0.74 CRHR1 (0.44) L3MBTL1HSD11B1CRHR1EGFRTUBB4A
SCHEMBL8300281 0.74 KMT2A (0.47) L3MBTL1HSD11B1
SCHEMBL30843099 0.72 L3MBTL1 (0.46) L3MBTL1HSD11B1CRHR1EGFRTUBB4A
SCHEMBL8303627 0.71 HSD11B1 (0.45) L3MBTL1HSD11B1CRHR1EGFRTUBB4A

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-5700824-A Triazole derivatives, insecticide, acaricide and methods thereof KUMIAI CHEMICAL INDUSTRIAL CO. LTD. (JP) 1997-12-23 US disclosed
US-5616594-A Triazole derivatives, insecticide, acaricide and methods thereof IHARA CHEMICAL INDUSTRY CO. LTD. (JP) 1997-04-01 US disclosed
EP-0648752-A1 TRIAZOLE DERIVATIVE, INSECTICIDAL/ACARICIDAL AGENT, AND PROCESS FOR PRODUCING THE SAME KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1995-04-19 EP disclosed