SCHEMBL792128

SCHEMBL792128

CC(=O)CN1CCc2c(C)c3ccc(C(C)=O)cc3n2CC1=O

nearest known ligand 0.32

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.32
APOBEC3A P31941 1/20 0.32
APOBEC3G Q9HC16 1/20 0.32
PTGDR2 Q9Y5Y4 1/20 0.31
ALDH1A1 P00352 1/20 0.31
POLB P06746 1/20 0.31
HDAC6 Q9UBN7 2/20 0.31
NPC1 O15118 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
HDAC1 Q13547 1/20 0.30
TP53 P04637 1/20 0.30

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
SCHEMBL792496 0.76 GAA (0.41) SIGMAR1APOBEC3AAPOBEC3GALDH1A1POLB
SCHEMBL792527 0.74 ALDH1A1 (0.41) SIGMAR1APOBEC3AAPOBEC3GALDH1A1POLB
SCHEMBL792525 0.74 GFER (0.41) ALDH1A1POLBNPC1
SCHEMBL792539 0.73 DRD3 (0.41) SIGMAR1ALDH1A1
SCHEMBL792516 0.71 HTR7 (0.34) APOBEC3AAPOBEC3GALDH1A1POLBL3MBTL1
SCHEMBL14572851 0.69 HTR2A (0.37) ALDH1A1NPC1L3MBTL1TP53
SCHEMBL792524 0.67 FABP4 (0.45) ALDH1A1POLB
SCHEMBL792588 0.64 ALDH1A1 (0.42) SIGMAR1ALDH1A1
SCHEMBL11315834 0.64
SCHEMBL792066 0.63 MTNR1A (0.47) NPC1

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-20120070409-A1 TETRACYCLIC FUSED HETEROCYCLIC COMPOUND AND USE THEREOF AS HCV POLYMERASE INHIBITOR JAPAN TOBACCO INC. (JP) 2012-03-22 US disclosed
US-7977331-B1 Tetracyclic fused heterocyclic compound and use thereof as HCV polymerase inhibitor JAPAN TOBACCO INC. (JP) 2011-07-12 US disclosed
US-20070049593-A1 Tetracyclic fused heterocyclic compound and use thereof as HCV polymerase inhibitor JAPAN TOBACCO INC. (JP) 2007-03-01 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 (2 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-20070049593-A1 Tetracyclic fused heterocyclic compound and use thereof as HCV polymerase inhibitor POLI, TERT, ZC3HAV1 SIGMAR1 3155/4885APOBEC3A 2977/4885APOBEC3G 3279/4885
US-20120070409-A1 TETRACYCLIC FUSED HETEROCYCLIC COMPOUND AND USE THEREOF AS HCV POLYMERASE INHIBITOR POLI, TERT, ZC3HAV1 SIGMAR1 3155/4885APOBEC3A 2977/4885APOBEC3G 3279/4885

“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.