SCHEMBL408193

SCHEMBL408193

COC(=O)c1oc(C)nc1C

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 11/20 0.53
LMNA P02545 4/20 0.53
MAPT P10636 6/20 0.49
HSD17B10 Q99714 9/20 0.46
POLB P06746 5/20 0.46
USP2 O75604 4/20 0.46
TSHR P16473 3/20 0.46
SMN1; SMN2 Q16637 5/20 0.45
HTT P42858 3/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
HPGD P15428 3/20 0.45
NPSR1 Q6W5P4 1/20 0.43
KDM4E B2RXH2 1/20 0.41
TDP1 Q9NUW8 3/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
NPC1 O15118 1/20 0.39
GAA P10253 1/20 0.39
RECQL P46063 1/20 0.39
RAB9A P51151 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
SCHEMBL25335115 0.82 NPSR1 (0.41) ALDH1A1LMNAMAPTHSD17B10POLB
SCHEMBL22308295 0.80 ALDH1A1 (0.50) ALDH1A1LMNAMAPTHSD17B10HTT
SCHEMBL3416276 0.80 ALDH1A1 (0.58) ALDH1A1LMNAMAPTHSD17B10POLB
SCHEMBL6802200 0.80 FBP1 (0.51) ALDH1A1LMNAMAPTHSD17B10SMN1; SMN2
SCHEMBL3274432 0.80 MAPT (0.47) ALDH1A1LMNAMAPTHSD17B10POLB
SCHEMBL22308291 0.79 ALDH1A1 (0.49) ALDH1A1LMNAMAPTHSD17B10SMN1; SMN2
SCHEMBL27432878 0.78 HSD17B10 (0.47) ALDH1A1LMNAMAPTHSD17B10POLB
SCHEMBL286999 0.78 HSD17B10 (0.47) ALDH1A1LMNAMAPTHSD17B10POLB
SCHEMBL11900084 0.77 ALDH1A1 (0.48) ALDH1A1LMNAMAPTHSD17B10POLB
SCHEMBL21158772 0.77 ALDH1A1 (0.38) ALDH1A1LMNAMAPTHSD17B10POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3255044-B1 DIAZA-BENZOFLUORANTHRENE COMPOUNDS HARBIN PHARMACEUTICAL GROUP CO LTD GENERAL PHARMACEUTICAL FACTORY (CN) 2020-04-01 EP disclosed
US-10017507-B2 Diaza-benzofluoranthrene compounds HARBIN PHARMACEUTICAL GROUP CO., LTD. GENERAL PHARMACEUTICAL FACTORY (CN) 2018-07-10 US disclosed
US-10017507-B2 Diaza-benzofluoranthrene compounds HARBIN PHARMACEUTICAL GROUP CO., LTD. GENERAL PHARMACEUTICAL FACTORY (CN) 2018-07-10 US disclosed
US-20180016270-A1 DIAZA-BENZOFLUORANTHRENE COMPOUNDS HARBIN PHARMACEUTICAL GROUP CO., LTD. GENERAL PHARMACEUTICAL FACTORY (CN) 2018-01-18 US disclosed
US-20180016270-A1 DIAZA-BENZOFLUORANTHRENE COMPOUNDS HARBIN PHARMACEUTICAL GROUP CO., LTD. GENERAL PHARMACEUTICAL FACTORY (CN) 2018-01-18 US disclosed
US-20120065196-A1 AMIDE COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-03-15 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 (3 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-20180016270-A1 DIAZA-BENZOFLUORANTHRENE COMPOUNDS DDT, CYP3A43, CYP19A1 ALDH1A1 187/4885LMNA 1836/4885MAPT 113/4885
US-10017507-B2 Diaza-benzofluoranthrene compounds DDT, CYP3A43, CYP19A1 ALDH1A1 187/4885LMNA 1836/4885MAPT 113/4885
US-20120065196-A1 AMIDE COMPOUNDS DGAT2, DGAT1, DLAT ALDH1A1 272/4885LMNA 4016/4885MAPT 1464/4885

“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.