SCHEMBL2464285

SCHEMBL2464285

Cc1cccc(NC2=C(N3CCCC3)C(=O)c3ccccc3C2=O)c1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ APAF1 O14727 12/20 0.72
▸ NPC1 O15118 5/20 0.72
▸ RAB9A P51151 4/20 0.72
▸ MAPT P10636 11/20 0.71
▸ ALDH1A1 P00352 10/20 0.71
▸ L3MBTL1 Q9Y468 7/20 0.71
▸ SMN1; SMN2 Q16637 6/20 0.71
▸ HTT P42858 5/20 0.71
▸ MEN1 O00255 5/20 0.71
▸ KMT2A Q03164 5/20 0.71
▸ GAA P10253 4/20 0.71
▸ NSD2 O96028 2/20 0.71
▸ NPSR1 Q6W5P4 2/20 0.71
▸ POLB P06746 5/20 0.71
▸ LMNA P02545 4/20 0.71
▸ MITF O75030 4/20 0.71
▸ KLF5 Q13887 1/20 0.71
▸ ADORA2A P29274 1/20 0.59
▸ KDM4E B2RXH2 4/20 0.58
▸ HPGD P15428 2/20 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
SCHEMBL14777417 0.89 MAPT (0.76) APAF1NPC1RAB9AMAPTALDH1A1
SCHEMBL4874221 0.85 APAF1 (0.97) APAF1NPC1RAB9AMAPTALDH1A1
SCHEMBL7247303 0.84 MAPT (0.97) APAF1NPC1RAB9AMAPTALDH1A1
SCHEMBL16297270 0.84 MAPT (0.71) APAF1NPC1RAB9AMAPTALDH1A1
SCHEMBL2462638 0.84 MAPT (0.71) APAF1NPC1RAB9AMAPTALDH1A1
SCHEMBL16297241 0.84 APAF1 (0.71) APAF1NPC1RAB9AMAPTALDH1A1
SCHEMBL5807881 0.84 APAF1 (1.00) APAF1NPC1RAB9AMAPTALDH1A1
SCHEMBL2462511 0.84 MAPT (0.67) APAF1NPC1RAB9AMAPTALDH1A1
SCHEMBL16297187 0.83 APAF1 (1.00) APAF1NPC1RAB9AMAPTALDH1A1
SCHEMBL16297028 0.83 MAPT (0.73) APAF1NPC1RAB9AMAPTALDH1A1

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 11 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-20170334842-A1 INHIBITORS OF THE MITF MOLECULAR PATHWAY UNIVERSITY OF KANSAS 2017-11-23 — — 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
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 (5 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 1324/4885NPC1 456/4885RAB9A 2936/4885
US-20160129006-A1 ANTIVIRAL COMPOUNDS AND METHODS OF USE THEREOF TYMP, MAVS, ZC3HAV1 APAF1 1324/4885NPC1 456/4885RAB9A 2936/4885
US-20130071353-A1 Antiviral Compounds and Methods of Use Thereof TYMP, MAVS, ZC3HAV1 APAF1 1324/4885NPC1 456/4885RAB9A 2936/4885
US-20170334842-A1 INHIBITORS OF THE MITF MOLECULAR PATHWAY MITF, TFEB, TYR APAF1 2521/4885NPC1 2867/4885RAB9A 746/4885
US-20190022100-A1 ANTIVIRAL COMPOUNDS AND METHODS OF USE THEREOF TYMP, MAVS, ZC3HAV1 APAF1 1324/4885NPC1 456/4885RAB9A 2936/4885

“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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