SCHEMBL4469417

SCHEMBL4469417

CNN=C(N)c1ccccn1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.67
NPC1 O15118 7/20 0.50
RAB9A P51151 7/20 0.50
MAPT P10636 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
TDP1 Q9NUW8 3/20 0.49
GAA P10253 1/20 0.49
CDK5 Q00535 3/20 0.47
CDK5R1 Q15078 3/20 0.47
PKM P14618 2/20 0.47
TOP2A P11388 1/20 0.47
MITF O75030 1/20 0.47
KDM4E B2RXH2 3/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
KMT2A Q03164 2/20 0.47
PAX8 Q06710 2/20 0.47
TP53 P04637 1/20 0.47
ALDH1A1 P00352 3/20 0.46
HTT P42858 1/20 0.45
NOS3 P29474 1/20 0.44

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
SCHEMBL4469414 1.00 LMNA (0.67) LMNANPC1RAB9AMAPTL3MBTL1
SCHEMBL7595958 0.79 TOP2A (0.66) LMNANPC1RAB9AMAPTL3MBTL1
SCHEMBL23550666 0.79 LMNA (0.55) LMNANPC1RAB9AMAPTL3MBTL1
SCHEMBL2931559 0.79 LMNA (0.54) LMNANPC1RAB9AL3MBTL1CDK5
SCHEMBL22872697 0.79 LMNA (0.54) LMNANPC1RAB9AL3MBTL1CDK5
SCHEMBL10157708 0.79 LMNA (0.54) LMNANPC1RAB9AL3MBTL1CDK5
SCHEMBL18653617 0.78 NPC1 (0.54) LMNANPC1RAB9AL3MBTL1CDK5
SCHEMBL640709 0.76 KDM4E (0.59) LMNANPC1RAB9AL3MBTL1CDK5
SCHEMBL1428592 0.76 KDM4E (0.54) LMNANPC1RAB9AL3MBTL1TDP1
SCHEMBL834329 0.76 KDM4E (0.54) LMNANPC1RAB9AL3MBTL1TDP1

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-11691992-B2 Oxaborole analogs and uses thereof ANACOR PHARMACEUTICALS, INC. (US) 2023-07-04 US disclosed
US-20210253605-A1 NOVEL OXABOROLE ANALOGS AND USES THEREOF ANACOR PHARMACEUTICALS INC (US) 2021-08-19 US disclosed
US-10961261-B2 Oxaborole analogs and uses thereof ANACOR PHARMACEUTICALS, INC. (US) 2021-03-30 US disclosed
EP-3609504-A1 NOVEL OXABOROLE ANALOGS AND USES THEREOF Anacor Pharmaceuticals, Inc. (US) 2020-02-19 EP disclosed
WO-2018160845-A1 NOVEL OXABOROLE ANALOGS AND USES THEREOF ANACOR PHARMACEUTICALS, INC. (US) 2018-09-07 WO disclosed
US-8268835-B2 Inhibitors of hepatitis C virus RNA-dependent RNA polymerase, and compositions and treatments using the same PFIZER INC. (US) 2012-09-18 US disclosed
US-7622605-B2 Inhibitors of hepatitis C virus RNA-dependent RNA polymerase, and compositions and treatments using the same PFIZER INC. (US) 2009-11-24 US disclosed
US-20090281122-A1 Inhibitors of Hepatitis C Virus RNA-Dependent RNA Polymerase, and Compositions and Treatments Using the Same PFIZER INC 2009-11-12 US disclosed
US-20070015764-A1 INHIBITORS OF HEPATITIS C VIRUS RNA-DEPENDENT RNA POLYMERASE, AND COMPOSITIONS AND TREATMENTS USING THE SAME AGOURON PHARMACEUTICALS, INC. 2007-01-18 US disclosed
US-7151105-B2 Inhibitors of Hepatitis C virus RNA-dependent RNA polymerase, and compositions and treatments using the same AGOURON PHARMACEUTICALS, INC. (US) 2006-12-19 US disclosed
US-20060122399-A1 Inhibitors of hepatitis C virus RNA-dependent RNA polymerase, and compositions and treatments using the same AGOURON PHARMACEUTICALS, INC. 2006-06-08 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 (6 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-20090281122-A1 Inhibitors of Hepatitis C Virus RNA-Dependent RNA Polymerase, and Compositions and Treatments Using the Same RNASE1, GTF3C4, POLRMT LMNA 2519/4885NPC1 219/4885RAB9A 3785/4885
US-11691992-B2 Oxaborole analogs and uses thereof OXA1L, EPX, OAT LMNA 2380/4885NPC1 818/4885RAB9A 2351/4885
US-20060122399-A1 Inhibitors of hepatitis C virus RNA-dependent RNA polymerase, and compositions and treatments using the same RNASE1, GTF3C4, POLRMT LMNA 2519/4885NPC1 219/4885RAB9A 3785/4885
US-20070015764-A1 INHIBITORS OF HEPATITIS C VIRUS RNA-DEPENDENT RNA POLYMERASE, AND COMPOSITIONS AND TREATMENTS USING THE SAME RNASE1, GTF3C4, POLRMT LMNA 2519/4885NPC1 219/4885RAB9A 3785/4885
US-20210253605-A1 NOVEL OXABOROLE ANALOGS AND USES THEREOF OXA1L, AOX1, EPX LMNA 3262/4885NPC1 645/4885RAB9A 1725/4885
US-10961261-B2 Oxaborole analogs and uses thereof OXA1L, EPX, OAT LMNA 2380/4885NPC1 818/4885RAB9A 2351/4885

“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.