SCHEMBL10012491

SCHEMBL10012491

C=CC(=O)Nc1ccc(C(OC(=O)O)c2ccc([N+](=O)[O-])cc2)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TGM2 P21980 8/20 0.70
▸ MEN1 O00255 8/20 0.47
▸ KMT2A Q03164 8/20 0.47
▸ RAB9A P51151 4/20 0.44
▸ MAPT P10636 3/20 0.44
▸ NPC1 O15118 2/20 0.44
▸ MAPK1 P28482 2/20 0.44
▸ POLB P06746 2/20 0.44
▸ MITF O75030 1/20 0.44
▸ NPSR1 Q6W5P4 1/20 0.44
▸ MYOC Q99972 1/20 0.44
▸ F13A1 P00488 1/20 0.42
▸ LMNA P02545 1/20 0.42
▸ TGM1 P22735 1/20 0.42
▸ TGM3 Q08188 1/20 0.42
▸ ALDH1A1 P00352 3/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.41
▸ GAA P10253 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41

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
SCHEMBL3919472 0.84 TGM2 (1.00) TGM2MEN1KMT2ARAB9AMAPT
SCHEMBL6639523 0.78 CES2 (0.50) MEN1KMT2ARAB9AMAPTNPC1
SCHEMBL10069262 0.76 TGM2 (0.82) TGM2MEN1KMT2ARAB9AMAPT
SCHEMBL21643199 0.75 ALDH1A1 (0.57) MEN1KMT2AMAPTMAPK1LMNA
SCHEMBL1311401 0.74 L3MBTL1 (0.51) MEN1KMT2ARAB9AMAPTNPC1
SCHEMBL6916147 0.74 TGM2 (0.57) TGM2POLBF13A1LMNATGM1
Hydrochloric Acid SCHEMBL1665213 0.73 L3MBTL1 (0.50) MEN1KMT2ARAB9AMAPTNPC1
SCHEMBL5495389 0.73 TDP1 (0.47) TGM2MEN1KMT2AMAPTNPC1
SCHEMBL16815164 0.72 TDP1 (0.40) MEN1KMT2AMAPTNPC1NPSR1
SCHEMBL20766118 0.71 KMT2A (0.56) MEN1KMT2ARAB9AMAPTNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3030244-B1 POLYCONJUGATES FOR DELIVERY OF RNAI TRIGGERS TO TUMOR CELLS IN VIVO ARROWHEAD PHARMACEUTICALS INC (US) 2021-04-21 — — EP disclosed
US-20170022497-A1 Polyconjugates for Delivery of RNAi triggers to Tumor Cells In Vivo Arrowhead Pharmaceuticals, Inc. 2017-01-26 — — US disclosed
US-9487556-B2 Polyconjugates for delivery of RNAi triggers to tumor cells in vivo Arrowhead Pharmaceuticals, Inc. (US) 2016-11-08 — — US disclosed
EP-3030244-A1 POLYCONJUGATES FOR DELIVERY OF RNAI TRIGGERS TO TUMOR CELLS IN VIVO Arrowhead Research Corporation (US) 2016-06-15 — — EP disclosed
WO-2015021092-A1 POLYCONJUGATES FOR DELIVERY OF RNAI TRIGGERS TO TUMOR CELLS IN VIVO ARROWHEAD RESEARCH CORPORATION (US) 2015-02-12 — — WO disclosed
US-20150045573-A1 Polyconjugates for Delivery of RNAi triggers to Tumor Cells In Vivo Arrowhead Pharmaceuticals, Inc. 2015-02-12 — — US disclosed
US-8802773-B2 In vivo polynucleotide delivery conjugates having enzyme sensitive linkages Arrowhead Madison Inc. (US) 2014-08-12 — — US disclosed
EP-2658579-A2 IN VIVO POLYNUCLEOTIDE DELIVERY CONJUGATES HAVING ENZYME SENSITIVE LINKAGES Arrowhead Research Corporation (US) 2013-11-06 — — EP disclosed
US-20130190484-A1 In Vivo Polynucleotide Delivery Conjugates Having Enzyme Sensitive Linkages Arrowhead Madison Inc. (US) 2013-07-25 — — US disclosed
US-8426554-B2 In vivo polynucleotide delivery conjugates having enzyme sensitive linkages Arrowhead Madison Inc. (US) 2013-04-23 — — US disclosed
WO-2012092373-A2 IN VIVO POLYNUCLEOTIDE DELIVERY CONJUGATES HAVING ENZYME SENSITIVE LINKAGES ARROWHEAD RESEARCH CORPORATION (US) 2012-07-05 — — WO disclosed
US-20120172412-A1 In Vivo Polynucleotide Delivery Conjugates Having Enzyme Sensitive Linkages Arrowhead Madison Inc. (US) 2012-07-05 — — 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 (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-20170022497-A1 Polyconjugates for Delivery of RNAi triggers to Tumor Cells In Vivo PAM, PLAUR, M6PR TGM2 2179/4885MEN1 483/4885KMT2A 734/4885
US-20150045573-A1 Polyconjugates for Delivery of RNAi triggers to Tumor Cells In Vivo PAM, PLAUR, M6PR TGM2 2179/4885MEN1 483/4885KMT2A 734/4885
US-20120172412-A1 In Vivo Polynucleotide Delivery Conjugates Having Enzyme Sensitive Linkages RNASE1, PNKP, POLM TGM2 2078/4885MEN1 1759/4885KMT2A 949/4885
US-20130190484-A1 In Vivo Polynucleotide Delivery Conjugates Having Enzyme Sensitive Linkages RNASE1, PNKP, POLM TGM2 2078/4885MEN1 1759/4885KMT2A 949/4885

“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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