SCHEMBL7347675

SCHEMBL7347675

CC(C)=C1Oc2cccc(OCc3cccc(CN4CCC(NC(=O)c5ccc(Cl)c(Cl)c5)CC4)c3)c2C1=O

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 8/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
SSTR5 P35346 1/20 0.48
KCNH2 Q12809 1/20 0.48
MCHR1 Q99705 2/20 0.47
DRD4 P21917 2/20 0.46
SLC6A12 P48065 1/20 0.45
SLC6A13 Q9NSD5 1/20 0.45
ACKR3 P25106 1/20 0.45
TMEM97 Q5BJF2 1/20 0.44

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
SCHEMBL7346827 0.92 SSTR5 (0.47) UTS2RMEN1KMT2ASSTR5KCNH2
SCHEMBL7347684 0.90 MCHR1 (0.53) MEN1KMT2ASSTR5MCHR1DRD4
SCHEMBL7350951 0.90 DRD4 (0.47) MEN1KMT2ASSTR5MCHR1DRD4
SCHEMBL6381981 0.86 HTR7 (0.49) UTS2RSSTR5KCNH2DRD4
SCHEMBL7353904 0.86 MCHR1 (0.55) MEN1KMT2ASSTR5KCNH2MCHR1
SCHEMBL6462162 0.85 MCHR1 (0.43) UTS2RMEN1KMT2ASSTR5KCNH2
SCHEMBL6462165 0.85 MCHR1 (0.43) UTS2RMEN1KMT2ASSTR5KCNH2
SCHEMBL7346919 0.84 UTS2R (0.42) UTS2RMEN1KMT2ASSTR5KCNH2
SCHEMBL7351045 0.84 HTR7 (0.47) UTS2RMEN1KMT2ASSTR5KCNH2
SCHEMBL7346972 0.84 SLC6A5 (0.60) MEN1KMT2ADRD4

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-6307051-B1 UROKINASE-TYPE PLASMINOGEN ACTIVATOR ANTAGONISTS AND HAVE ANTITUMOR AND ANTIMETASTATIC ACTIVITY. ROCHE DIAGNOSTICS GMBH (DE) 2001-10-23 US claimed
US-6307051-B1 UROKINASE-TYPE PLASMINOGEN ACTIVATOR ANTAGONISTS AND HAVE ANTITUMOR AND ANTIMETASTATIC ACTIVITY. ROCHE DIAGNOSTICS GMBH (DE) 2001-10-23 US disclosed
EP-1026165-A1 O-substituted Hydroxycoumaranone derivatives as antitumor and antimetastatic agents Roche Diagnostics GmbH (DE) 2000-08-09 EP disclosed