SCHEMBL7911252

SCHEMBL7911252

O=C(CCCl)Oc1cccc2c1C(=O)C=CC2=O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLM Q9NP87 2/20 0.67
POLK Q9UBT6 2/20 0.67
POLL Q9UGP5 2/20 0.67
POLH Q9Y253 2/20 0.67
TOP1 P11387 3/20 0.57
ALDH1A1 P00352 2/20 0.44
MAPT P10636 2/20 0.44
IDO1 P14902 2/20 0.44
CDC25B P30305 2/20 0.44
PIN1 Q13526 2/20 0.44
KDM4E B2RXH2 2/20 0.44
MEN1 O00255 2/20 0.44
RECQL P46063 2/20 0.44
KMT2A Q03164 2/20 0.44
AURKA O14965 1/20 0.44
USP2 O75604 1/20 0.44
TRPA1 O75762 1/20 0.44
TP53 P04637 1/20 0.44
P4HB P07237 1/20 0.44
CYP3A4 P08684 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
SCHEMBL10394363 0.88 POLM (0.63) POLMPOLKPOLLPOLHTOP1
SCHEMBL10395154 0.82 POLM (0.63) POLMPOLKPOLLPOLHTOP1
SCHEMBL3054875 0.82 POLM (0.63) POLMPOLKPOLLPOLHTOP1
SCHEMBL1287104 0.76 TOP1 (0.65) POLMPOLKPOLLPOLHTOP1
SCHEMBL31448099 0.75 POLM (1.00) POLMPOLKPOLLPOLHTOP1
SCHEMBL9711411 0.73 TOP1 (0.51) POLMPOLKPOLLPOLHTOP1
SCHEMBL6662940 0.73 TOP1 (0.60) POLMPOLKPOLLPOLHTOP1
SCHEMBL12827331 0.73 TOP1 (1.00) POLMPOLKPOLLPOLHTOP1
SCHEMBL9006672 0.72 TOP1 (0.59) POLMPOLKPOLLPOLHTOP1
SCHEMBL5817354 0.72 TOP1 (0.53) POLMPOLKPOLLPOLHTOP1

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
US-6214969-B1 MODIFIED DECAPEPTPIDE; ANTITUMOR AGENTS; ANTICARCINOGENIC AGENTS THE ADMINISTRATORS OF THE TULANE EDUCATIONAL FUND 2001-04-10 US disclosed
WO-1992022322-A1 LHRH ANALOGS THE ADMINISTRATORS OF THE TULANE EDUCATIONAL FUND (US) 1992-12-23 WO disclosed
EP-0450461-A2 LHRH Analogs The Administrators of The Tulane Educational Fund (US) 1991-10-09 EP disclosed
EP-0450480-A2 Somatostatin Analogues The Administrators of The Tulane Educational Fund (US) 1991-10-09 EP disclosed