SCHEMBL418392

SCHEMBL418392

COC(=O)c1cc(Cl)ccc1NC(=O)/C=C/c1cccc(Br)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.53
MEN1 O00255 2/20 0.53
NPC1 O15118 2/20 0.53
RAB9A P51151 2/20 0.53
KMT2A Q03164 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
CYP1A2 P05177 1/20 0.53
CYP3A4 P08684 1/20 0.53
CYP2C19 P33261 1/20 0.53
ALDH1A1 P00352 5/20 0.53
HPGD P15428 5/20 0.53
KDM4E B2RXH2 2/20 0.53
EGFR P00533 1/20 0.52
MMP1 P03956 5/20 0.51
MMP2 P08253 5/20 0.51
MMP9 P14780 5/20 0.51
MAPT P10636 1/20 0.50
SLC6A19 Q695T7 1/20 0.50
NPSR1 Q6W5P4 2/20 0.49
STAT3 P40763 1/20 0.49

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
SCHEMBL418393 1.00 MAOB (0.53) MAOBMEN1NPC1RAB9AKMT2A
SCHEMBL8064046 0.87 TRPM2 (0.61) MAOBMEN1NPC1RAB9AKMT2A
SCHEMBL8064044 0.87 TRPM2 (0.61) MAOBMEN1NPC1RAB9AKMT2A
SCHEMBL420830 0.86 EGFR (0.57) MAOBMEN1NPC1RAB9AKMT2A
SCHEMBL420831 0.86 EGFR (0.57) MAOBMEN1NPC1RAB9AKMT2A
SCHEMBL418156 0.81 ALDH1A1 (0.59) MEN1NPC1RAB9AKMT2ASMN1; SMN2
SCHEMBL418157 0.81 ALDH1A1 (0.59) MEN1NPC1RAB9AKMT2ASMN1; SMN2
SCHEMBL417435 0.81 ALDH1A1 (0.47) MAOBMEN1NPC1RAB9AKMT2A
SCHEMBL417436 0.81 ALDH1A1 (0.47) MAOBMEN1NPC1RAB9AKMT2A
SCHEMBL8065719 0.81 GRIK1 (0.61) MAOBMEN1NPC1RAB9AKMT2A

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 MAOB 1039/4885MEN1 844/4885NPC1 893/4885
US-20120022080-A1 Plasminogen Activator Inhibitor-1 Inhibitor SERPINE1, SERPINC1, SERPINB1 MAOB 1039/4885MEN1 844/4885NPC1 893/4885

“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.