SCHEMBL4160132

SCHEMBL4160132

CCc1ncc(Cl)cc1C(=O)OC

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 4/20 0.44
ABL1 P00519 1/20 0.41
CNR1 P21554 1/20 0.40
NR4A2 P43354 2/20 0.40
ALDH1A1 P00352 1/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
KMT2A Q03164 2/20 0.40
RXFP1 Q9HBX9 2/20 0.40
SLC6A4 P31645 1/20 0.40
SLC6A3 Q01959 1/20 0.40
SERPINH1 P50454 1/20 0.38
MEN1 O00255 1/20 0.38
HPGD P15428 1/20 0.37
LMNA P02545 1/20 0.37
KDM4E B2RXH2 1/20 0.37

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
SCHEMBL4919152 0.87 OPRK1 (0.44) OPRK1ABL1NR4A2ALDH1A1NPC1
SCHEMBL29227006 0.87 OPRK1 (0.44) OPRK1ABL1NR4A2ALDH1A1NPC1
SCHEMBL24365123 0.81 OPRK1 (0.44) OPRK1ABL1ALDH1A1NPC1RAB9A
SCHEMBL16880713 0.81 OPRK1 (0.47) OPRK1NPC1RAB9AKMT2A
SCHEMBL473981 0.80 OPRK1 (0.48) OPRK1ABL1NR4A2ALDH1A1NPC1
SCHEMBL30816026 0.80 OPRK1 (0.48) OPRK1ABL1NR4A2ALDH1A1NPC1
SCHEMBL3981418 0.78 DPP4 (0.48) OPRK1ALDH1A1NPC1RAB9ALMNA
SCHEMBL401530 0.78 OPRK1 (0.47) OPRK1ABL1NR4A2ALDH1A1NPC1
SCHEMBL4443153 0.78 HSP90AA1 (0.47) CNR1ALDH1A1SLC6A4SLC6A3HPGD
SCHEMBL4447411 0.78 LMNA (0.46) KMT2AMEN1HPGDLMNAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090227591-A1 Cyclopentene compounds GLAXO GROUP LIMITED (GB) 2009-09-10 US disclosed
US-20090227591-A1 Cyclopentene compounds GLAXO GROUP LIMITED (GB) 2009-09-10 US disclosed
US-20090227591-A1 Cyclopentene compounds GLAXO GROUP LIMITED (GB) 2009-09-10 US disclosed
EP-1670763-A1 CYCLOPENTENE COMPOUNDS GLAXO GROUP LIMITED (GB) 2006-06-21 EP disclosed
WO-2005037793-A1 CYCLOPENTENE COMPOUNDS GLAXO GROUP LIMITED (GB) 2005-04-28 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090227591-A1 Cyclopentene compounds C1R, CYP1B1, ADORA2B OPRK1 1388/4885ABL1 2527/4885CNR1 32/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.