SCHEMBL417241

SCHEMBL417241

O=C(O)C(=O)Nc1ccc(C23CC4CC(CC(C4)C2)C3)cc1

nearest known ligand 0.69

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.69
EPHX2 P34913 9/20 0.64
LMNA P02545 2/20 0.57
MAPT P10636 2/20 0.57
SMN1; SMN2 Q16637 2/20 0.56
TEAD4 Q15561 1/20 0.51
TEAD2 Q15562 1/20 0.51
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49
CA9 Q16790 1/20 0.49
PGR P06401 1/20 0.48
ALDH1A1 P00352 1/20 0.47
CYP2C9 P11712 1/20 0.47
HIF1A Q16665 1/20 0.47

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
SCHEMBL15048924 0.87 NPC1 (0.73) NPC1EPHX2LMNAMAPTSMN1; SMN2
SCHEMBL22445036 0.82 NPC1 (1.00) NPC1EPHX2LMNAMAPTSMN1; SMN2
SCHEMBL421042 0.79 NPC1 (0.62) NPC1EPHX2LMNAMAPTSMN1; SMN2
SCHEMBL22452619 0.78 NPC1 (0.61) NPC1EPHX2LMNAMAPTSMN1; SMN2
SCHEMBL21551680 0.77 NPC1 (0.49) NPC1EPHX2LMNAMAPTSMN1; SMN2
SCHEMBL22453210 0.76 NPC1 (0.59) NPC1EPHX2LMNAMAPTSMN1; SMN2
SCHEMBL22453447 0.76 NPC1 (0.59) NPC1EPHX2LMNAMAPTSMN1; SMN2
SCHEMBL419525 0.76 SERPINE1 (0.74) NPC1EPHX2LMNAMAPTSMN1; SMN2
SCHEMBL22453003 0.76 NPC1 (0.58) NPC1EPHX2LMNAMAPTSMN1; SMN2
SCHEMBL22452802 0.76 NPC1 (0.58) NPC1EPHX2LMNAMAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2607348-B1 Plasminogen Activator Inhibitor-1 Inhibitor RENASCIENCE INC (JP) 2021-03-17 EP disclosed
US-20140296256-A1 PLASMINOGEN ACTIVATOR INHIBITOR-1 INHIBITOR RENASCIENCE CO LTD (JP) 2014-10-02 US disclosed
US-8785473-B2 Plasminogen activator inhibitor-1 inhibitor RENASCIENCE CO., LTD. (JP) 2014-07-22 US disclosed
EP-2607348-A2 Plasminogen Activator Inhibitor-1 Inhibitor Renascience CO., LTD. (JP) 2013-06-26 EP disclosed
EP-2415755-A1 PLASMINOGEN ACTIVATOR INHIBITOR-1 INHIBITOR Renascience CO., LTD. (JP) 2012-02-08 EP disclosed
US-20120022080-A1 Plasminogen Activator Inhibitor-1 Inhibitor RENASCIENCE CO., LTD. (JP) 2012-01-26 US 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 (2 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-20140296256-A1 PLASMINOGEN ACTIVATOR INHIBITOR-1 INHIBITOR SERPINE1, SERPINC1, SERPINB1 NPC1 893/4885EPHX2 2172/4885LMNA 482/4885
US-20120022080-A1 Plasminogen Activator Inhibitor-1 Inhibitor SERPINE1, SERPINC1, SERPINB1 NPC1 893/4885EPHX2 2172/4885LMNA 482/4885

“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.