SCHEMBL2465538

SCHEMBL2465538

O=C1C(Nc2cccc(O)c2)=C(N2CCCCC2)C(=O)c2ccccc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 12/20 1.00
▸ APAF1 O14727 11/20 1.00
▸ ALDH1A1 P00352 8/20 1.00
▸ SMN1; SMN2 Q16637 6/20 1.00
▸ RAB9A P51151 5/20 1.00
▸ L3MBTL1 Q9Y468 5/20 1.00
▸ MEN1 O00255 5/20 1.00
▸ KMT2A Q03164 5/20 1.00
▸ HTT P42858 4/20 1.00
▸ NPSR1 Q6W5P4 3/20 1.00
▸ GAA P10253 3/20 1.00
▸ NSD2 O96028 2/20 1.00
▸ NPC1 O15118 5/20 0.73
▸ POLB P06746 5/20 0.73
▸ LMNA P02545 3/20 0.73
▸ MITF O75030 1/20 0.73
▸ KLF5 Q13887 1/20 0.73
▸ CDC25A P30304 1/20 0.59
▸ CDC25B P30305 1/20 0.59
▸ MAPK1 P28482 3/20 0.58

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
SCHEMBL16297187 0.85 APAF1 (1.00) MAPTAPAF1ALDH1A1SMN1; SMN2RAB9A
SCHEMBL16297028 0.85 MAPT (0.73) MAPTAPAF1ALDH1A1SMN1; SMN2RAB9A
SCHEMBL16296842 0.85 APAF1 (0.73) MAPTAPAF1ALDH1A1SMN1; SMN2RAB9A
SCHEMBL4872810 0.84 MAPT (0.76) MAPTAPAF1ALDH1A1SMN1; SMN2RAB9A
SCHEMBL7247303 0.83 MAPT (0.97) MAPTAPAF1ALDH1A1SMN1; SMN2RAB9A
SCHEMBL2464285 0.83 APAF1 (0.72) MAPTAPAF1ALDH1A1SMN1; SMN2RAB9A
SCHEMBL16297270 0.83 MAPT (0.71) MAPTAPAF1ALDH1A1SMN1; SMN2RAB9A
SCHEMBL16297241 0.83 APAF1 (0.71) MAPTAPAF1ALDH1A1SMN1; SMN2RAB9A
SCHEMBL2462638 0.83 MAPT (0.71) MAPTAPAF1ALDH1A1SMN1; SMN2RAB9A
SCHEMBL2462507 0.81 APAF1 (0.69) MAPTAPAF1ALDH1A1SMN1; SMN2RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190022100-A1 ANTIVIRAL COMPOUNDS AND METHODS OF USE THEREOF TRANA DISCOVERY INC (US) 2019-01-24 — — US disclosed
US-10098887-B2 Antiviral compounds and methods of use thereof TRANA DISCOVERY, INC. (US) 2018-10-16 — — US disclosed
US-20160129006-A1 ANTIVIRAL COMPOUNDS AND METHODS OF USE THEREOF TRANA DISCOVERY INC (US) 2016-05-12 — — US disclosed
US-20160129006-A1 ANTIVIRAL COMPOUNDS AND METHODS OF USE THEREOF TRANA DISCOVERY INC (US) 2016-05-12 — — US disclosed
US-9173886-B2 Antiviral compounds and methods of use thereof TRANA DISCOVERY, INC. (US) 2015-11-03 — — US disclosed
US-9173886-B2 Antiviral compounds and methods of use thereof TRANA DISCOVERY, INC. (US) 2015-11-03 — — US disclosed
US-20130071353-A1 Antiviral Compounds and Methods of Use Thereof TRANA DISCOVERY, INC (US) 2013-03-21 — — US disclosed
US-20130071353-A1 Antiviral Compounds and Methods of Use Thereof TRANA DISCOVERY, INC (US) 2013-03-21 — — US disclosed
WO-2011113060-A2 ANTIVIRAL COMPOUNDS AND METHODS OF USE THEREOF TRANA DISCOVERY, INC. (US) 2011-09-15 — — WO 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 (4 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-10098887-B2 Antiviral compounds and methods of use thereof TYMP, MAVS, ZC3HAV1 MAPT 3443/4885APAF1 1324/4885ALDH1A1 2506/4885
US-20160129006-A1 ANTIVIRAL COMPOUNDS AND METHODS OF USE THEREOF TYMP, MAVS, ZC3HAV1 MAPT 3443/4885APAF1 1324/4885ALDH1A1 2506/4885
US-20130071353-A1 Antiviral Compounds and Methods of Use Thereof TYMP, MAVS, ZC3HAV1 MAPT 3443/4885APAF1 1324/4885ALDH1A1 2506/4885
US-20190022100-A1 ANTIVIRAL COMPOUNDS AND METHODS OF USE THEREOF TYMP, MAVS, ZC3HAV1 MAPT 3443/4885APAF1 1324/4885ALDH1A1 2506/4885

“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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