SCHEMBL4892547

SCHEMBL4892547

C[C@@H]1C[C@H](C)CN(C(=O)N(C(=O)CNC(=O)c2cccnc2Cl)c2ccc(Cl)cc2)C1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.40
EGFR P00533 1/20 0.39
POLB P06746 1/20 0.39
FAAH O00519 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
LMNA P02545 1/20 0.38
HPGD P15428 1/20 0.38
KMT2A Q03164 2/20 0.38
TDP1 Q9NUW8 1/20 0.37
MEN1 O00255 1/20 0.37
CYP2C19 P33261 1/20 0.37
KDM4E B2RXH2 1/20 0.36
GAA P10253 1/20 0.36

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
SCHEMBL4892997 0.84 KMT2A (0.46) ALDH1A1POLBSMN1; SMN2HPGDKMT2A
SCHEMBL4887565 0.77 SLC6A9 (0.43) ALDH1A1SMN1; SMN2HPGDKMT2AMEN1
SCHEMBL4893181 0.77 THRB (0.43) ALDH1A1EGFRSMN1; SMN2LMNAKMT2A
SCHEMBL4894897 0.76 KMT2A (0.44) ALDH1A1SMN1; SMN2LMNAHPGDKMT2A
SCHEMBL4893717 0.76 L3MBTL1 (0.44) ALDH1A1SMN1; SMN2LMNAHPGDKMT2A
SCHEMBL4882730 0.76 THRB (0.42) ALDH1A1KMT2AMEN1KDM4EGAA
SCHEMBL4896093 0.75 KMT2A (0.46) ALDH1A1POLBSMN1; SMN2HPGDKMT2A
SCHEMBL4892539 0.75 GAA (0.43) ALDH1A1SMN1; SMN2LMNAKMT2ATDP1
SCHEMBL4883922 0.75 RAB9A (0.50) ALDH1A1SMN1; SMN2LMNAHPGDKMT2A
SCHEMBL4892456 0.70 THRB (0.38) ALDH1A1KMT2AMEN1KDM4EGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080200512-A1 Hepatitis C virus polymerase inhibitors BLANEY JEFFREY MARK 2008-08-21 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-20080200512-A1 Hepatitis C virus polymerase inhibitors SSU72, POLR2H, POLR2E ALDH1A1 276/4885EGFR 569/4885POLB 79/4885

“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.