SCHEMBL2462507

SCHEMBL2462507

COc1cccc(NC2=C(N3CCCCC3)C(=O)c3ccccc3C2=O)c1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ APAF1 O14727 9/20 0.69
▸ MAPT P10636 8/20 0.69
▸ ALDH1A1 P00352 7/20 0.69
▸ MEN1 O00255 6/20 0.69
▸ KMT2A Q03164 6/20 0.69
▸ SMN1; SMN2 Q16637 5/20 0.69
▸ HTT P42858 5/20 0.69
▸ L3MBTL1 Q9Y468 5/20 0.69
▸ RAB9A P51151 4/20 0.69
▸ GAA P10253 4/20 0.69
▸ NSD2 O96028 2/20 0.69
▸ NPSR1 Q6W5P4 2/20 0.69
▸ NPC1 O15118 5/20 0.68
▸ POLB P06746 5/20 0.68
▸ LMNA P02545 2/20 0.68
▸ MITF O75030 1/20 0.68
▸ KLF5 Q13887 1/20 0.68
▸ MAPK1 P28482 2/20 0.67
▸ PTBP1 P26599 1/20 0.67
▸ CDC25A P30304 1/20 0.61

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
SCHEMBL2462511 0.99 MAPT (0.67) APAF1MAPTALDH1A1MEN1KMT2A
SCHEMBL2463229 0.88 MAPT (0.66) APAF1MAPTALDH1A1MEN1KMT2A
SCHEMBL12333471 0.87 MAPT (0.67) APAF1MAPTALDH1A1MEN1KMT2A
SCHEMBL16297222 0.86 APAF1 (0.74) APAF1MAPTALDH1A1MEN1KMT2A
SCHEMBL7243360 0.85 APAF1 (0.72) APAF1MAPTALDH1A1MEN1KMT2A
SCHEMBL2464285 0.83 APAF1 (0.72) APAF1MAPTALDH1A1MEN1KMT2A
SCHEMBL16297187 0.82 APAF1 (1.00) APAF1MAPTALDH1A1MEN1KMT2A
SCHEMBL2465538 0.81 MAPT (1.00) APAF1MAPTALDH1A1MEN1KMT2A
SCHEMBL16297028 0.81 MAPT (0.73) APAF1MAPTALDH1A1MEN1KMT2A
SCHEMBL16296842 0.81 APAF1 (0.73) APAF1MAPTALDH1A1MEN1KMT2A

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 10 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
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 APAF1 1324/4885MAPT 3443/4885ALDH1A1 2506/4885
US-20160129006-A1 ANTIVIRAL COMPOUNDS AND METHODS OF USE THEREOF TYMP, MAVS, ZC3HAV1 APAF1 1324/4885MAPT 3443/4885ALDH1A1 2506/4885
US-20130071353-A1 Antiviral Compounds and Methods of Use Thereof TYMP, MAVS, ZC3HAV1 APAF1 1324/4885MAPT 3443/4885ALDH1A1 2506/4885
US-20190022100-A1 ANTIVIRAL COMPOUNDS AND METHODS OF USE THEREOF TYMP, MAVS, ZC3HAV1 APAF1 1324/4885MAPT 3443/4885ALDH1A1 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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