SCHEMBL4887134

SCHEMBL4887134

C[C@@H]1C[C@H](C)CN(C(=O)c2cc(Br)ccc2NC(=O)CNC(=O)Cc2ccccc2)C1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.47
LMNA P02545 3/20 0.47
HTT P42858 2/20 0.47
NPSR1 Q6W5P4 2/20 0.47
KMT2A Q03164 3/20 0.46
MEN1 O00255 2/20 0.46
ALDH1A1 P00352 5/20 0.45
POLB P06746 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.43
MAPT P10636 1/20 0.43
KDM4E B2RXH2 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
PKM P14618 1/20 0.40
RAB9A P51151 1/20 0.40

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
SCHEMBL4887551 0.89 ALDH1A1 (0.43) NPSR1KMT2AALDH1A1SMN1; SMN2KDM4E
SCHEMBL4896087 0.87 HTT (0.64) HPGDLMNAHTTNPSR1KMT2A
SCHEMBL4886246 0.86 KDM4E (0.44) HPGDLMNAHTTNPSR1KMT2A
SCHEMBL4892479 0.85 KDM4E (0.44) HPGDLMNAHTTNPSR1KMT2A
SCHEMBL4896562 0.85 LMNA (0.47) LMNAHTTNPSR1KMT2AMEN1
SCHEMBL4889448 0.84 HPGD (0.42) HPGDLMNAHTTNPSR1KMT2A
SCHEMBL4898676 0.84 KDM4E (0.50) LMNAHTTNPSR1KMT2AALDH1A1
SCHEMBL4892636 0.84 LMNA (0.45) HPGDLMNAHTTNPSR1KMT2A
SCHEMBL4887300 0.83 CFD (0.49) HPGDLMNAHTTKMT2AMEN1
SCHEMBL4896576 0.81 HTT (0.46) HPGDLMNAHTTNPSR1KMT2A

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 3 patents. 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
US-20080200512-A1 Hepatitis C virus polymerase inhibitors BLANEY JEFFREY MARK 2008-08-21 US disclosed
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 HPGD 1356/4885LMNA 3432/4885HTT 2341/4885

“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.