SCHEMBL3105348

SCHEMBL3105348

COC(=O)C=Cc1cccc2c1CCC2

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.43
▸ MAPT P10636 3/20 0.43
▸ KDM4E B2RXH2 3/20 0.43
▸ MEN1 O00255 3/20 0.43
▸ KMT2A Q03164 3/20 0.43
▸ TP53 P04637 1/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ CYP2C9 P11712 1/20 0.43
▸ HPGD P15428 1/20 0.43
▸ ALOX15 P16050 1/20 0.43
▸ CYP2C19 P33261 1/20 0.43
▸ HSD17B10 Q99714 1/20 0.43
▸ LMNA P02545 3/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ NFKB1 P19838 1/20 0.43
▸ RECQL P46063 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ NFKB2 Q00653 1/20 0.43
▸ RELA Q04206 1/20 0.43

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
SCHEMBL3105338 1.00 ALDH1A1 (0.43) ALDH1A1MAPTKDM4EMEN1KMT2A
SCHEMBL9251495 0.82 ALDH1A1 (0.40) ALDH1A1MAPTKDM4EMEN1KMT2A
SCHEMBL9251499 0.82 ALDH1A1 (0.40) ALDH1A1MAPTKDM4EMEN1KMT2A
SCHEMBL11813693 0.82 L3MBTL1 (0.46) ALDH1A1MAPTKDM4EMEN1KMT2A
SCHEMBL11813691 0.82 L3MBTL1 (0.46) ALDH1A1MAPTKDM4EMEN1KMT2A
SCHEMBL11812725 0.78 CA1 (0.47) ALDH1A1MAPTKDM4EMEN1KMT2A
SCHEMBL11812719 0.78 CA1 (0.47) ALDH1A1MAPTKDM4EMEN1KMT2A
SCHEMBL22319906 0.78 ABHD6 (0.40) ALDH1A1MAPTKDM4EMEN1KMT2A
SCHEMBL3114278 0.75 LMNA (0.40) ALDH1A1MAPTKDM4EMEN1KMT2A
SCHEMBL3114283 0.75 LMNA (0.40) ALDH1A1MAPTKDM4EMEN1KMT2A

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 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200385340-A1 HEPATITIS C ANTIVIRAL COMPOSITIONS AND METHODS BIOTRON LTD (AU) 2020-12-10 — — US disclosed
US-10683263-B2 Antiviral compounds and methods BIOTRON LIMITED (AU) 2020-06-16 — — US disclosed
EP-2826770-B1 ACYLGUANIDINE COMPOUNDS WITH ANTIVIRAL ACTIVITY BIOTRON LTD (AU) 2018-09-12 — — EP disclosed
US-20170362170-A1 HEPATITIS C ANTIVIRAL COMPOSITIONS AND METHODS BIOTRON LTD (AU) 2017-12-21 — — US disclosed
US-20160376231-A1 ANTIVIRAL COMPOUNDS AND METHODS BIOTRON LIMITED (AU) 2016-12-29 — — US disclosed
EP-2659885-B1 Hepatitis C Antiviral Compositions and Methods BIOTRON LTD (AU) 2016-11-09 — — EP disclosed
US-9440926-B2 Antiviral compounds and methods BIOTRON LIMITED (AU) 2016-09-13 — — US disclosed
EP-2194976-B1 Hepatitis C antiviral compositions comprising 5-(1-methylpyrazol-4-yl)2-naphthoylguanidine and 2'-C-methyladenosine or 2'-C-methylcytidine BIOTRON LTD (AU) 2015-12-09 — — EP disclosed
US-20150023921-A1 HEPATITIS C ANTIVIRAL COMPOSITIONS AND METHODS BIOTRON LIMITED (AU) 2015-01-22 — — US disclosed
EP-2826770-A1 Acylguanidine compounds with antiviral activity Biotron Limited (AU) 2015-01-21 — — EP disclosed
CN-103274970-A Antiviral compounds and methods BIOTRON LTD 2013-09-04 — — CN disclosed
CN-101208297-B Antiviral compounds and methods BIOTRON LTD 2013-04-24 — — CN disclosed
US-20100254942-A1 HEPATITIS C ANTIVIRAL COMPOSITIONS AND METHODS BIOTRON LIMITED (AU) 2010-10-07 — — US disclosed
CN-101827589-A Hepatitis c antiviral compositions and methods BIOTROM LTD 2010-09-08 — — CN disclosed
EP-2194976-A1 HEPATITIS C ANTIVIRAL COMPOSITIONS AND METHODS Biotron Limited (AU) 2010-06-16 — — EP disclosed
US-20090099239-A1 Antiviral Compounds and Methods BIOTRON LIMITED (AU) 2009-04-16 — — US disclosed
WO-2009018609-A1 HEPATITIS C ANTIVIRAL COMPOSITIONS AND METHODS BIOTROM LIMITED (AU) 2009-02-12 — — WO disclosed
CN-101208297-A Antiviral compounds and methods BIOTRON LTD (AU) 2008-06-25 — — CN disclosed
EP-1902017-A1 ANTIVIRAL COMPOUNDS AND METHODS Biotron Limited (AU) 2008-03-26 — — EP disclosed
WO-2006135978-A1 ANTIVIRAL COMPOUNDS AND METHODS BIOTRON LIMITED (AU) 2006-12-28 — — 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 (7 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-20100254942-A1 HEPATITIS C ANTIVIRAL COMPOSITIONS AND METHODS HAVCR2, HCCS, EIF2AK2 ALDH1A1 2228/4885MAPT 4416/4885KDM4E 3855/4885
US-20150023921-A1 HEPATITIS C ANTIVIRAL COMPOSITIONS AND METHODS HAVCR2, HCCS, EIF2AK2 ALDH1A1 2228/4885MAPT 4416/4885KDM4E 3855/4885
US-10683263-B2 Antiviral compounds and methods MAVS, ZC3HAV1, EIF2AK2 ALDH1A1 3086/4885MAPT 4471/4885KDM4E 2925/4885
US-20170362170-A1 HEPATITIS C ANTIVIRAL COMPOSITIONS AND METHODS HAVCR2, HCCS, EIF2AK2 ALDH1A1 2228/4885MAPT 4416/4885KDM4E 3855/4885
US-20090099239-A1 Antiviral Compounds and Methods MAVS, ZC3HAV1, EIF2AK2 ALDH1A1 3086/4885MAPT 4471/4885KDM4E 2925/4885
US-20160376231-A1 ANTIVIRAL COMPOUNDS AND METHODS MAVS, ZC3HAV1, EIF2AK2 ALDH1A1 3086/4885MAPT 4471/4885KDM4E 2925/4885
US-20200385340-A1 HEPATITIS C ANTIVIRAL COMPOSITIONS AND METHODS HAVCR2, HCCS, EIF2AK2 ALDH1A1 2228/4885MAPT 4416/4885KDM4E 3855/4885

“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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