SCHEMBL1796032

SCHEMBL1796032

COC(=O)c1cc(Cl)ccc1NC(=O)COCC(=O)N1CCCCC1Oc1ccc(Cc2ccccc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ SERPINE1 P05121 1/20 0.45
▸ ALDH1A1 P00352 3/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ CYP3A4 P08684 1/20 0.43
▸ CYP2C9 P11712 1/20 0.43
▸ CYP2C19 P33261 1/20 0.43
▸ THRB P10828 1/20 0.42
▸ SMN1; SMN2 Q16637 3/20 0.41
▸ POLB P06746 2/20 0.40
▸ LMNA P02545 2/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ KMT2A Q03164 4/20 0.40
▸ MEN1 O00255 3/20 0.40
▸ TP53 P04637 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ MAPT P10636 4/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ CPT1A P50416 1/20 0.38

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
SCHEMBL1798359 0.93 SERPINE1 (0.53) SERPINE1ALDH1A1CYP1A2CYP3A4CYP2C9
SCHEMBL17530215 0.92 SERPINE1 (0.52) SERPINE1ALDH1A1CYP1A2CYP3A4CYP2C9
SCHEMBL1796188 0.91 SERPINE1 (0.45) SERPINE1ALDH1A1CYP1A2CYP3A4CYP2C9
SCHEMBL1796031 0.85 SERPINE1 (0.53) SERPINE1ALDH1A1CYP1A2CYP3A4CYP2C9
SCHEMBL1798357 0.77 SERPINE1 (0.62) SERPINE1ALDH1A1POLBLMNAKDM4E
SCHEMBL1796187 0.75 SERPINE1 (0.53) SERPINE1ALDH1A1CYP1A2CYP3A4CYP2C9
SCHEMBL1796028 0.73 SERPINE1 (0.61) SERPINE1ALDH1A1CYP1A2CYP3A4CYP2C9
SCHEMBL1014777 0.72 ALDH1A1 (0.46) SERPINE1ALDH1A1CYP1A2CYP3A4CYP2C9
SCHEMBL1794335 0.72 SMN1; SMN2 (0.69) ALDH1A1CYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL1015912 0.72 RAB9A (0.55) ALDH1A1SMN1; SMN2POLBLMNAKDM4E

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 1/4885ALDH1A1 800/4885CYP1A2 3135/4885

“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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