SCHEMBL8774904

SCHEMBL8774904

CCC1CCC(CCc2ccc(-c3cnc(Cl)c(Cl)c3)cc2)CC1

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.36
MAOB P27338 3/20 0.35
MAP4K4 O95819 1/20 0.34
MAOA P21397 1/20 0.33
DGAT1 O75907 1/20 0.32
TNIK Q9UKE5 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
CHEK1 O14757 1/20 0.32
ACHE P22303 1/20 0.32
CNR1 P21554 1/20 0.32
KCNH2 Q12809 1/20 0.32
FFAR4 Q5NUL3 1/20 0.32
FAAH O00519 1/20 0.32

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
SCHEMBL8774899 1.00 GPR84 (0.36) GPR84MAOBMAP4K4MAOADGAT1
SCHEMBL8774303 0.92 GPR84 (0.36) GPR84MAOBMAP4K4MAOADGAT1
SCHEMBL8774299 0.92 GPR84 (0.36) GPR84MAOBMAP4K4MAOADGAT1
SCHEMBL8774323 0.90 GPR84 (0.38) GPR84MAOBMAP4K4MAOAMEN1
SCHEMBL8774328 0.90 GPR84 (0.38) GPR84MAOBMAP4K4MAOAMEN1
SCHEMBL8774205 0.89 AKR1C2 (0.36) GPR84MAOBMAOAMEN1KMT2A
SCHEMBL8774201 0.89 AKR1C2 (0.36) GPR84MAOBMAOAMEN1KMT2A
SCHEMBL8774209 0.88 MAPT (0.37) GPR84MEN1KMT2A
SCHEMBL8774204 0.88 MAPT (0.37) GPR84MEN1KMT2A
SCHEMBL8774260 0.88 MAPT (0.37) GPR84MEN1KMT2A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0519370-B1 Heterocyclic derivatives MERCK PATENT GMBH (DE) 1997-11-05 EP disclosed
EP-0519370-A2 Heterocyclic derivatives MERCK PATENT GmbH (DE) 1992-12-23 EP disclosed