SCHEMBL2464412

SCHEMBL2464412

Fc1ccc(CNc2ccc(N3CCCC3)cc2)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 11/20 0.67
▸ MAPT P10636 11/20 0.67
▸ L3MBTL1 Q9Y468 10/20 0.67
▸ KDM4E B2RXH2 10/20 0.67
▸ ALOX15 P16050 7/20 0.67
▸ ALOX12 P18054 6/20 0.67
▸ SMN1; SMN2 Q16637 6/20 0.67
▸ GFER P55789 2/20 0.67
▸ ALDH1A1 P00352 8/20 0.63
▸ MAPK1 P28482 7/20 0.63
▸ MEN1 O00255 4/20 0.63
▸ KMT2A Q03164 4/20 0.63
▸ TDP1 Q9NUW8 4/20 0.63
▸ APP P05067 1/20 0.63
▸ SNCA P37840 1/20 0.63
▸ RAB9A P51151 3/20 0.56
▸ NPC1 O15118 2/20 0.56
▸ HTT P42858 5/20 0.55
▸ PLA2G1B P04054 1/20 0.55
▸ ATG4B Q9Y4P1 1/20 0.55

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
SCHEMBL3063745 0.86 GAA (0.70) GAAMAPTL3MBTL1KDM4EALOX15
SCHEMBL4931553 0.84 GAA (0.57) GAAMAPTL3MBTL1KDM4EALOX15
SCHEMBL2475972 0.84 GAA (0.63) GAAMAPTL3MBTL1KDM4EALOX15
SCHEMBL14680275 0.81 MAPT (0.78) GAAMAPTL3MBTL1KDM4EALOX15
SCHEMBL2462363 0.81 L3MBTL1 (1.00) GAAMAPTL3MBTL1KDM4EALOX15
SCHEMBL10055033 0.80 LMNA (0.61) GAAMAPTL3MBTL1KDM4EALOX15
SCHEMBL6419238 0.80 LMNA (0.61) GAAMAPTL3MBTL1KDM4EALOX15
SCHEMBL13879814 0.80 L3MBTL1 (0.63) GAAMAPTL3MBTL1KDM4EALOX15
SCHEMBL1843773 0.80 MAPT (0.80) GAAMAPTL3MBTL1KDM4EALOX15
SCHEMBL19648939 0.79 MAPT (0.59) GAAMAPTKDM4EALOX15SMN1; SMN2

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
WO-2012079032-A2 COMPOSITIONS AND METHODS OF TREATING DRUG-RESISTANT RETROVIRAL INFECTIONS TRANA DISCOVERY, INC. (US) 2012-06-14 — — WO claimed
WO-2011113060-A2 ANTIVIRAL COMPOUNDS AND METHODS OF USE THEREOF TRANA DISCOVERY, INC. (US) 2011-09-15 — — WO claimed
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-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
WO-2012079032-A2 COMPOSITIONS AND METHODS OF TREATING DRUG-RESISTANT RETROVIRAL INFECTIONS TRANA DISCOVERY, INC. (US) 2012-06-14 — — 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 GAA 75/4885MAPT 3443/4885L3MBTL1 528/4885
US-20160129006-A1 ANTIVIRAL COMPOUNDS AND METHODS OF USE THEREOF TYMP, MAVS, ZC3HAV1 GAA 75/4885MAPT 3443/4885L3MBTL1 528/4885
US-20130071353-A1 Antiviral Compounds and Methods of Use Thereof TYMP, MAVS, ZC3HAV1 GAA 75/4885MAPT 3443/4885L3MBTL1 528/4885
US-20190022100-A1 ANTIVIRAL COMPOUNDS AND METHODS OF USE THEREOF TYMP, MAVS, ZC3HAV1 GAA 75/4885MAPT 3443/4885L3MBTL1 528/4885

“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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