SCHEMBL2182563

SCHEMBL2182563

COc1ccccc1CC(N)=NOC(=O)COc1ccc(C)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 1.00
▸ HTT P42858 1/20 1.00
▸ L3MBTL1 Q9Y468 10/20 0.78
▸ SMN1; SMN2 Q16637 3/20 0.78
▸ TDP1 Q9NUW8 8/20 0.75
▸ MAPK1 P28482 3/20 0.71
▸ ALDH1A1 P00352 2/20 0.67
▸ HPGD P15428 1/20 0.67
▸ NPSR1 Q6W5P4 1/20 0.60
▸ KDM4E B2RXH2 2/20 0.58
▸ CYP1A2 P05177 1/20 0.58
▸ CYP3A4 P08684 1/20 0.58
▸ CYP2C19 P33261 1/20 0.58
▸ NPC1 O15118 2/20 0.56
▸ MEN1 O00255 1/20 0.56
▸ POLB P06746 1/20 0.56
▸ RECQL P46063 1/20 0.56
▸ KMT2A Q03164 1/20 0.56
▸ RAB9A P51151 1/20 0.54

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
SCHEMBL2182559 1.00 MAPT (1.00) MAPTHTTL3MBTL1SMN1; SMN2TDP1
SCHEMBL23094250 0.90 MAPT (0.81) MAPTHTTL3MBTL1SMN1; SMN2TDP1
SCHEMBL23094169 0.90 MAPT (0.81) MAPTHTTL3MBTL1SMN1; SMN2TDP1
SCHEMBL21467841 0.88 L3MBTL1 (1.00) MAPTHTTL3MBTL1SMN1; SMN2TDP1
SCHEMBL23094182 0.88 MAPT (0.78) MAPTHTTL3MBTL1SMN1; SMN2TDP1
SCHEMBL23094234 0.86 MAPT (0.76) MAPTHTTL3MBTL1SMN1; SMN2TDP1
SCHEMBL23094164 0.86 TDP1 (1.00) MAPTHTTL3MBTL1SMN1; SMN2TDP1
SCHEMBL23094202 0.85 TDP1 (0.81) MAPTHTTL3MBTL1SMN1; SMN2TDP1
SCHEMBL23094264 0.85 MAPT (0.74) MAPTHTTL3MBTL1SMN1; SMN2TDP1
SCHEMBL23094183 0.84 MAPT (0.73) MAPTHTTL3MBTL1SMN1; SMN2TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9949980-B2 Drugs to prevent HPV infection WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2018-04-24 — — US disclosed
US-20150297602-A1 DRUGS TO PREVENT HPV INFECTION NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2015-10-22 — — US disclosed
US-9066951-B2 Drugs to treat HPV infection WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2015-06-30 — — US disclosed
US-20110165220-A1 DRUGS TO PREVENT HPV INFECTION WISCONSIN ALUMNI RESEARCH FOUNDATION 2011-07-07 — — 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-20110165220-A1 DRUGS TO PREVENT HPV INFECTION VHL, PHF13, CDKN1A MAPT 4500/4885HTT 2217/4885L3MBTL1 2983/4885
US-20150297602-A1 DRUGS TO PREVENT HPV INFECTION VHL, PHF13, CDKN1A MAPT 4500/4885HTT 2217/4885L3MBTL1 2983/4885

“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.

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