SCHEMBL4886273

SCHEMBL4886273

CCC1CC(C)CN(C(=O)c2cc(Br)ccc2NC(=O)CNC(=O)c2ccco2)C1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.46
HSD17B10 Q99714 1/20 0.46
RAB9A P51151 3/20 0.44
HTT P42858 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
POLB P06746 4/20 0.41
ALDH1A1 P00352 3/20 0.41
KMT2A Q03164 1/20 0.41
NAMPT P43490 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
NPC1 O15118 1/20 0.39

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
SCHEMBL4898676 0.93 KDM4E (0.50) KDM4EHSD17B10RAB9AHTTNPSR1
SCHEMBL14103623 0.92 KDM4E (0.44) KDM4EHSD17B10RAB9AHTTNPSR1
SCHEMBL4887003 0.86 HTT (0.57) HTTNPSR1POLBALDH1A1KMT2A
SCHEMBL4893569 0.85 POLB (0.40) KDM4EHTTNPSR1POLBALDH1A1
SCHEMBL4892536 0.83 ALDH1A1 (0.54) KDM4EHSD17B10RAB9AHTTPOLB
SCHEMBL4883902 0.82 KDM4E (0.46) KDM4EHSD17B10RAB9AHTTNPSR1
SCHEMBL4892453 0.82 HTT (0.46) KDM4EHSD17B10HTTNPSR1POLB
SCHEMBL4895640 0.81 KDM4E (0.53) KDM4EHSD17B10RAB9APOLBALDH1A1
SCHEMBL14087778 0.81 POLB (0.37) KDM4EHSD17B10RAB9AHTTNPSR1
SCHEMBL14087795 0.79 HTT (0.42) KDM4ERAB9AHTTNPSR1POLB

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 KDM4E 2519/4885HSD17B10 240/4885RAB9A 2778/4885

“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.