SCHEMBL4672803

SCHEMBL4672803

CCc1c(C(=O)O)oc2ccccc12.c1cc2cc-2c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 5/20 0.54
BCL2 P10415 1/20 0.49
BCL2L1 Q07817 1/20 0.49
BAD Q92934 1/20 0.49
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
TSHR P16473 1/20 0.48
APEX1 P27695 1/20 0.48
MAPK1 P28482 1/20 0.47
PLK1 P53350 1/20 0.46
EDNRA P25101 1/20 0.43
MMP2 P08253 1/20 0.43
MMP13 P45452 1/20 0.43
CAPN1 P07384 1/20 0.42
LMNA P02545 1/20 0.42
TP53 P04637 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
KDM4E B2RXH2 2/20 0.42
AHR P35869 1/20 0.42

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
SCHEMBL2773751 0.91 MCL1 (0.58) MCL1BCL2BCL2L1BADMEN1
SCHEMBL5273001 0.81 CAPN1 (0.56) MCL1BCL2BCL2L1BADMEN1
SCHEMBL13348987 0.80 PLK1 (0.51) MCL1MEN1KMT2ATSHRPLK1
SCHEMBL4093872 0.79 PLK1 (0.52) MCL1TSHRMAPK1PLK1LMNA
SCHEMBL28131940 0.77 TEAD1 (0.51) MEN1KMT2ATSHRPLK1CAPN1
SCHEMBL27556248 0.77 MCL1 (0.60) MCL1BCL2BCL2L1BADMEN1
Oxalic Acid SCHEMBL28849573 0.77 ALDH1A1 (0.49) MCL1MEN1KMT2ATSHRPLK1
SCHEMBL4672754 0.77 MCL1 (0.65) MCL1BCL2BCL2L1BADMEN1
SCHEMBL1443853 0.75 MCL1 (0.58) MCL1BCL2BCL2L1BADMEN1
SCHEMBL9393930 0.75 PLK1 (0.64) MCL1BCL2BCL2L1BADMEN1

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
EP-1397341-B1 6-(ARYL-AMIDO OR ARYL-AMIDOMETHYL)-NAPHTHALEN-2-YLOXY-ACIDIC DERIVATIVES AS INHIBITORS OF PLASMINOGEN ACTIVATOR INHIBITOR TYPE-1 (PAI-1) WYETH CORP (US) 2008-08-06 EP disclosed
EP-1397341-A1 6-(ARYL-AMIDO OR ARYL-AMIDOMETHYL)-NAPHTHALEN-2-YLOXY-ACIDIC DERIVATIVES AS INHIBITORS OF PLASMINOGEN ACTIVATOR INHIBITOR TYPE-1 (PAI-1) Wyeth (US) 2004-03-17 EP disclosed
US-6589970-B2 This invention provides novel compounds, pharmaceutical compositions and methods of treating thrombotic disorders in mammals, the compounds having the formula: WYETH 2003-07-08 US disclosed
US-20030045560-A1 6-(Aryl-amido or aryl-amidomethyl)-naphthalen-2-yloxy-acidic derivatives as inhibitors of plasminogen activator inhibitor type-1 (PAI-1) WYETH 2003-03-06 US disclosed
WO-2003000649-A1 6-(ARYL-AMIDO OR ARYL-AMIDOMETHYL)-NAPHTHALEN-2-YLOXY-ACIDIC DERIVATIVES AS INHIBITORS OF PLASMINOGEN ACTIVATOR INHIBITOR TYPE-1 (PAI-1) WYETH (US) 2003-01-03 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-20030045560-A1 6-(Aryl-amido or aryl-amidomethyl)-naphthalen-2-yloxy-acidic derivatives as inhibitors of plasminogen activator inhibitor type-1 (PAI-1) SERPINC1, F11, SERPINE1 MCL1 787/4885BCL2 3830/4885BCL2L1 2101/4885

“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.