SCHEMBL1800112

SCHEMBL1800112

COC(=O)c1cc(Cl)ccc1NC(=O)COCC(=O)N1CCN(C2c3ccccc3-c3ccccc32)CC1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SERPINE1 P05121 1/20 0.56
▸ NPSR1 Q6W5P4 6/20 0.48
▸ MAPT P10636 5/20 0.48
▸ L3MBTL1 Q9Y468 1/20 0.48
▸ TSHR P16473 3/20 0.48
▸ KMT2A Q03164 3/20 0.48
▸ MEN1 O00255 1/20 0.48
▸ GPR55 Q9Y2T6 1/20 0.48
▸ CYP1A2 P05177 3/20 0.46
▸ CYP3A4 P08684 3/20 0.46
▸ CYP2C9 P11712 3/20 0.46
▸ CYP2C19 P33261 3/20 0.46
▸ SMN1; SMN2 Q16637 3/20 0.46
▸ HTT P42858 3/20 0.46
▸ USP2 O75604 2/20 0.46
▸ CYP2D6 P10635 2/20 0.46
▸ LMNA P02545 2/20 0.43
▸ TP53 P04637 1/20 0.43
▸ CACNA1G O43497 1/20 0.43
▸ ALDH1A1 P00352 3/20 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
SCHEMBL1797842 0.91 SERPINE1 (0.68) SERPINE1NPSR1MAPTL3MBTL1TSHR
SCHEMBL1798483 0.81 CYP2C9 (0.58) SERPINE1NPSR1MAPTTSHRKMT2A
SCHEMBL1798810 0.81 SERPINE1 (0.84) SERPINE1CYP3A4USP2CYP2D6CACNA1G
SCHEMBL1796607 0.80 SERPINE1 (0.58) SERPINE1NPSR1MAPTTSHRKMT2A
SCHEMBL1796028 0.78 SERPINE1 (0.61) SERPINE1NPSR1MAPTL3MBTL1TSHR
SCHEMBL1799657 0.76 SERPINE1 (0.70) SERPINE1KMT2AMEN1CYP1A2CYP3A4
SCHEMBL1798779 0.76 SERPINE1 (0.62) SERPINE1NPSR1MAPTL3MBTL1TSHR
SCHEMBL1799721 0.74 SERPINE1 (0.75) SERPINE1CYP3A4USP2CYP2D6CACNA1G
SCHEMBL1015370 0.74 KDM4E (0.60) SERPINE1MAPTTSHRKMT2AMEN1
SCHEMBL1794335 0.73 SMN1; SMN2 (0.69) MAPTKMT2AMEN1CYP1A2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7951806-B2 Plasminogen activator inhibitor-1 inhibitor RENASCIENCE CO., LTD. (JP) 2011-05-31 — — US disclosed
US-20090124620-A1 PLASMINOGEN ACTIVATOR INHIBITOR-1 INHIBITOR RENASCIENCE CO., LTD. (JP) 2009-05-14 — — 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 (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-20090124620-A1 PLASMINOGEN ACTIVATOR INHIBITOR-1 INHIBITOR SERPINE1, SERPINC1, SERPINB1 SERPINE1 1/4885NPSR1 2115/4885MAPT 2975/4885

“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.

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