SCHEMBL7375019

SCHEMBL7375019

[CH2]c1ccc2snc(CC)c2c1

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GRM4 Q14833 3/20 0.34
ATM Q13315 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
PDE3B Q13370 1/20 0.30
PDE3A Q14432 1/20 0.30

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
SCHEMBL7377972 0.76 GRM4 (0.38) GRM4
SCHEMBL7378228 0.75 EPAS1 (0.33)
SCHEMBL7375260 0.75 ALDH1A1 (0.32)
SCHEMBL8371416 0.73 MAPT (0.50) GRM4ATML3MBTL1
SCHEMBL7377529 0.72 KDM4E (0.53)
SCHEMBL7372919 0.71 CHRM4 (0.31)
SCHEMBL7378229 0.71 EPAS1 (0.35)
SCHEMBL16417562 0.69 HTR6 (0.36) GRM4
SCHEMBL12235214 0.69 GRM4 (0.43) GRM4ATML3MBTL1PDE3BPDE3A
SCHEMBL7352623 0.68 TTK (0.35) GRM4

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
WO-1997008150-A1 SUBSTITUTED CYCLIC UREAS AND DERIVATIVES THEREOF USEFUL AS RETROVIRAL PROTEASE INHIBITORS THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1997-03-06 WO claimed
US-5763469-A Substituted cyclic ureas and derivatives thereof useful as retroviral protease inhibitors THE DUPONT MERCK PHARMACEUTICAL COMPANY (US) 1998-06-09 US disclosed
WO-1997008150-A1 SUBSTITUTED CYCLIC UREAS AND DERIVATIVES THEREOF USEFUL AS RETROVIRAL PROTEASE INHIBITORS THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1997-03-06 WO disclosed