SCHEMBL6727907

SCHEMBL6727907

O=C(O)c1cc(I)c(OCc2ccccc2Cl)c(I)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 4/20 0.61
NPC1 O15118 2/20 0.60
RAB9A P51151 2/20 0.60
FABP4 P15090 3/20 0.52
FABP5 Q01469 3/20 0.52
MAOA P21397 1/20 0.49
MAOB P27338 1/20 0.49
ALKBH1 Q13686 1/20 0.47
HDAC8 Q9BY41 2/20 0.47
TP53 P04637 2/20 0.47
HTT P42858 1/20 0.47
GCK P35557 1/20 0.46
MCL1 Q07820 1/20 0.45
NR4A1 P22736 1/20 0.45
NR4A3 Q92570 1/20 0.45
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
HPGD P15428 2/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
MITF O75030 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
SCHEMBL6725945 0.87 TPMT (0.44) NR4A2NPC1RAB9ANR4A1NR4A3
SCHEMBL6725244 0.83 MAOB (0.49) MAOBALKBH1GCK
SCHEMBL4273058 0.83 THRA (0.51) NR4A2NPC1RAB9AMAOBMEN1
SCHEMBL4273222 0.83 ALDH1A1 (0.54) NR4A2NPC1RAB9AMEN1KMT2A
SCHEMBL6723594 0.82 FFAR1 (0.47) MCL1KMT2ARXRARXRBFFAR1
SCHEMBL1263196 0.81 NR4A2 (0.78) NR4A2NPC1RAB9AFABP4FABP5
SCHEMBL12432458 0.81 HDAC8 (0.59) NR4A2NPC1RAB9AFABP4FABP5
SCHEMBL4269670 0.80 MEN1 (0.63) NR4A2NR4A1NR4A3MEN1KMT2A
SCHEMBL6726446 0.80 MAOB (0.52) MAOAMAOBRXRARXRBFFAR1
SCHEMBL4268890 0.80 ALKBH1 (0.50) NR4A2NPC1RAB9AMAOBALKBH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2001036351-A2 PLASMINOGEN ACTIVATOR INHIBITOR ANTAGONISTS RELATED APPLICATIONS CORVAS INTERNATIONAL, INC. (US) 2001-05-25 WO claimed
US-6677473-B1 TREATMENT, PREVENTION OR AMELIORATION OF ONE OR MORE SYMPTOMS OF THROMBOTIC DISORDERS, UNSTABLE ANGINA OR CANCER CORVAS INTERNATIONAL INC 2004-01-13 US disclosed
WO-2003009871-A2 INHIBITORS OF PLASMINOGEN ACTIVATOR INHIBITOR FOR DECREASING BODY MASS GENSET S.A. (FR) 2003-02-06 WO disclosed
WO-2001036351-A2 PLASMINOGEN ACTIVATOR INHIBITOR ANTAGONISTS RELATED APPLICATIONS CORVAS INTERNATIONAL, INC. (US) 2001-05-25 WO disclosed