SCHEMBL1797245

SCHEMBL1797245

COC(=O)c1cc(Cl)ccc1NC(=O)CCCCC(=O)Nc1ccc(Cl)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.52
POLB P06746 2/20 0.52
L3MBTL1 Q9Y468 2/20 0.50
RXFP1 Q9HBX9 1/20 0.48
KDM4E B2RXH2 3/20 0.48
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
HDAC1 Q13547 4/20 0.46
HDAC3 O15379 3/20 0.46
HDAC4 P56524 3/20 0.46
HDAC7 Q8WUI4 3/20 0.46
HDAC2 Q92769 3/20 0.46
HDAC10 Q969S8 3/20 0.46
HDAC11 Q96DB2 3/20 0.46
HDAC8 Q9BY41 3/20 0.46
HDAC6 Q9UBN7 3/20 0.46
HDAC9 Q9UKV0 3/20 0.46
HDAC5 Q9UQL6 3/20 0.46
CASP1 P29466 1/20 0.46
MAPT P10636 1/20 0.46

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
SCHEMBL1798425 0.90 EPHX2 (0.48) HDAC1HDAC3HDAC4HDAC7HDAC2
SCHEMBL1797516 0.87 ALDH1A1 (0.50) ALDH1A1POLBL3MBTL1RXFP1KDM4E
SCHEMBL9194516 0.87 ALDH1A1 (0.64) ALDH1A1POLBRXFP1KDM4EMEN1
SCHEMBL1015904 0.86 ALDH1A1 (0.54) ALDH1A1POLBRXFP1KDM4EMEN1
SCHEMBL1797318 0.85 ALDH1A1 (0.60) ALDH1A1POLBKDM4EMEN1KMT2A
SCHEMBL1796902 0.85 TP53 (0.65) ALDH1A1POLBL3MBTL1KDM4EMEN1
Hydrochloric Acid SCHEMBL420699 0.85 RXFP1 (0.48) ALDH1A1POLBL3MBTL1RXFP1KDM4E
SCHEMBL1794956 0.82 ALDH1A1 (0.56) ALDH1A1L3MBTL1MEN1KMT2AHDAC1
SCHEMBL417874 0.81 RXFP1 (0.54) ALDH1A1RXFP1KDM4EMEN1KMT2A
Trifluoroacetic Acid SCHEMBL1798236 0.80 KDM4E (0.45) ALDH1A1POLBRXFP1KDM4EMEN1

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 ALDH1A1 800/4885POLB 2674/4885L3MBTL1 2672/4885

“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.