SCHEMBL4884288

SCHEMBL4884288

CCC1CC(C)CN(C(=O)c2cc(Br)ccc2NC(=O)CCC(=O)N2CCOCC2)C1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.41
POLB P06746 3/20 0.41
LMNA P02545 1/20 0.39
SMN1; SMN2 Q16637 3/20 0.38
MAPT P10636 2/20 0.38
KDM4E B2RXH2 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
HSD17B10 Q99714 2/20 0.38
GLA P06280 1/20 0.38
GAA P10253 1/20 0.38
HPGD P15428 1/20 0.38
HTT P42858 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
TDP1 Q9NUW8 1/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
TP53 P04637 1/20 0.37
TSHR P16473 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
SCHEMBL21067812 0.93 ALDH1A1 (0.45) ALDH1A1POLBLMNASMN1; SMN2MAPT
SCHEMBL14103274 0.92 ALDH1A1 (0.40) ALDH1A1POLBLMNASMN1; SMN2MAPT
SCHEMBL4886249 0.90 POLB (0.41) ALDH1A1POLBLMNASMN1; SMN2MAPT
SCHEMBL4887377 0.84 POLB (0.43) ALDH1A1POLBSMN1; SMN2KDM4EL3MBTL1
SCHEMBL4896609 0.84 KMT2A (0.47) ALDH1A1POLBSMN1; SMN2KDM4EL3MBTL1
SCHEMBL4893921 0.83 KDM4E (0.45) ALDH1A1LMNASMN1; SMN2MAPTKDM4E
SCHEMBL4894751 0.83 POLB (0.43) ALDH1A1POLBLMNASMN1; SMN2MAPT
SCHEMBL4896082 0.82 POLB (0.43) ALDH1A1POLBLMNASMN1; SMN2MAPT
SCHEMBL4896941 0.82 ALDH1A1 (0.47) ALDH1A1LMNASMN1; SMN2MAPTKDM4E
SCHEMBL4894280 0.81 ALDH1A1 (0.43) ALDH1A1POLBLMNAMAPTKDM4E

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 ALDH1A1 276/4885POLB 79/4885LMNA 3432/4885

“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.