SCHEMBL5019518

SCHEMBL5019518

C[C@@H](Nc1ncnc2[nH]cnc12)c1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.64
SMN1; SMN2 Q16637 1/20 0.64
HSD17B10 Q99714 1/20 0.64
GALR3 O60755 1/20 0.55
NR2F2 P24468 1/20 0.55
EGFR P00533 13/20 0.53
AURKA O14965 2/20 0.50
RPS6KB1 P23443 2/20 0.50
TNF P01375 1/20 0.50
RAB9A P51151 1/20 0.50
NOD1 Q9Y239 1/20 0.50
AURKB Q96GD4 1/20 0.50
KRAS P01116 1/20 0.47
SOS1 Q07889 1/20 0.47

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
SCHEMBL14713436 1.00 LMNA (0.64) LMNASMN1; SMN2HSD17B10GALR3NR2F2
SCHEMBL2623141 1.00 LMNA (0.64) LMNASMN1; SMN2HSD17B10GALR3NR2F2
SCHEMBL4569248 0.82 LMNA (0.44) LMNASMN1; SMN2HSD17B10GALR3NR2F2
SCHEMBL4572186 0.82 RPS6KB1 (0.53) LMNASMN1; SMN2HSD17B10EGFRAURKA
SCHEMBL4569247 0.82 LMNA (0.44) LMNASMN1; SMN2HSD17B10GALR3NR2F2
SCHEMBL4572192 0.82 RPS6KB1 (0.53) LMNASMN1; SMN2HSD17B10EGFRAURKA
SCHEMBL7773690 0.81 LMNA (0.43) LMNASMN1; SMN2HSD17B10GALR3NR2F2
SCHEMBL6016566 0.80 LMNA (0.42) LMNASMN1; SMN2HSD17B10EGFRAURKA
SCHEMBL5019511 0.79 MAP4K4 (0.40) LMNASMN1; SMN2HSD17B10RAB9A
SCHEMBL7778515 0.79 LMNA (0.41) LMNASMN1; SMN2HSD17B10GALR3NR2F2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102812033-A N6-substituted adenosine derivatives and N6-substituted adenine derivatives and uses thereof INST MATERIA MEDICA CAMS 2012-12-05 CN claimed
US-20220162215-A1 COMPOSITIONS AND METHODS OF USING THE SAME FOR TREATMENT OF NEURODEGENERATIVE AND MITOCHONDRIAL DISEASE MITOKININ INC (US) 2022-05-26 US disclosed
WO-2020206363-A1 COMPOSITIONS AND METHODS OF USING THE SAME FOR TREATMENT OF NEURODEGENERATIVE AND MITOCHONDRIAL DISEASE MITOKININ,INC. (US) 2020-10-08 WO disclosed
EP-2427195-B1 HETEROCYCLIC COMPOUNDS AND USES THEREOF INTELLIKINE LLC (US) 2019-05-01 EP disclosed
US-10174033-B2 N6-substituted adenosine derivatives and N6-substituted adenine derivatives and uses thereof INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF MEDICAL SCIENCES (CN) 2019-01-08 US disclosed
US-9388183-B2 Heterocyclic compounds and uses thereof INFINITY PHARMACEUTICALS, INC. (US) 2016-07-12 US disclosed
US-9315505-B2 Heterocyclic compounds and uses thereof INTELLIKINE LLC (US) 2016-04-19 US disclosed
US-20150031672-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF INFINITY PHARMACEUTICALS, INC. 2015-01-29 US disclosed
US-8901133-B2 Heterocyclic compounds and uses thereof INFINITY PHARMACEUTICALS, INC. (US) 2014-12-02 US disclosed
US-20140296207-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF INTELLIKINE, INC. 2014-10-02 US disclosed
US-8785454-B2 Heterocyclic compounds and uses thereof INTELLIKINE LLC (US) 2014-07-22 US disclosed
US-20130045942-A1 N6-SUBSTITUTED ADENOSINE DERIVATIVES AND N6-SUBSTITUTED ADENINE DERIVATIVES AND USES THEREOF INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF MEDICAL SCIENCES (CN) 2013-02-21 US disclosed
US-20130045942-A1 N6-SUBSTITUTED ADENOSINE DERIVATIVES AND N6-SUBSTITUTED ADENINE DERIVATIVES AND USES THEREOF INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF MEDICAL SCIENCES (CN) 2013-02-21 US disclosed
CN-102812033-A N6-substituted adenosine derivatives and N6-substituted adenine derivatives and uses thereof INST MATERIA MEDICA CAMS 2012-12-05 CN disclosed
WO-2012064973-A2 HETEROCYCLIC COMPOUNDS AND USES THEREOF INFINITY PHARMACEUTICALS, INC. (US) 2012-05-18 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-20150031672-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF PIK3CA, PIK3CD, PIK3CB LMNA 1475/4885SMN1; SMN2 1464/4885HSD17B10 1927/4885
US-20220162215-A1 COMPOSITIONS AND METHODS OF USING THE SAME FOR TREATMENT OF NEURODEGENERATIVE AND MITOCHONDRIAL DISEASE NLN, PINK1, NME4 LMNA 626/4885SMN1; SMN2 73/4885HSD17B10 903/4885
US-10174033-B2 N6-substituted adenosine derivatives and N6-substituted adenine derivatives and uses thereof ADORA2A, ADORA3, ADORA1 LMNA 812/4885SMN1; SMN2 330/4885HSD17B10 4656/4885
US-20130045942-A1 N6-SUBSTITUTED ADENOSINE DERIVATIVES AND N6-SUBSTITUTED ADENINE DERIVATIVES AND USES THEREOF ADORA2A, ADORA3, ADORA1 LMNA 812/4885SMN1; SMN2 330/4885HSD17B10 4656/4885
US-20140296207-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF PIK3CA, AKT3, PIK3CD LMNA 1113/4885SMN1; SMN2 2594/4885HSD17B10 2578/4885

“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.