SCHEMBL16899014

SCHEMBL16899014

O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2ccccc2)n1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.77
MEN1 O00255 5/20 0.77
SIRT1 Q96EB6 2/20 0.67
NPC1 O15118 5/20 0.65
RAB9A P51151 5/20 0.65
GBA1 P04062 1/20 0.65
RXFP1 Q9HBX9 1/20 0.58
SMN1; SMN2 Q16637 3/20 0.57
ADORA3 P0DMS8 1/20 0.57
PIM1 P11309 1/20 0.57
ADORA2A P29274 1/20 0.57
ADORA2B P29275 1/20 0.57
ADORA1 P30542 1/20 0.57
FLT3 P36888 1/20 0.57
PIM3 Q86V86 1/20 0.57
AURKB Q96GD4 1/20 0.57
CNR1 P21554 1/20 0.56
HPSE Q9Y251 1/20 0.55
TP53 P04637 1/20 0.55
EPHX1 P07099 1/20 0.55

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
SCHEMBL821839 0.88 KMT2A (1.00) KMT2AMEN1NPC1RAB9ARXFP1
SCHEMBL19501815 0.81 SIRT1 (1.00) KMT2AMEN1SIRT1NPC1RAB9A
SCHEMBL2664547 0.80 KMT2A (0.83) KMT2AMEN1NPC1RAB9ARXFP1
SCHEMBL10464975 0.80 RAB9A (0.69) KMT2AMEN1NPC1RAB9AGBA1
SCHEMBL19491390 0.80 SIRT1 (1.00) KMT2AMEN1SIRT1NPC1RAB9A
SCHEMBL1142765 0.79 RAB9A (1.00) KMT2AMEN1NPC1RAB9AGBA1
SCHEMBL28937146 0.78 KMT2A (0.79) KMT2AMEN1NPC1RAB9ARXFP1
SCHEMBL12010921 0.77 SIRT1 (0.92) KMT2AMEN1SIRT1NPC1RAB9A
SCHEMBL12113118 0.77 SIRT1 (0.92) KMT2AMEN1SIRT1NPC1RAB9A
SCHEMBL23286796 0.77 KMT2A (0.77) KMT2AMEN1NPC1RAB9ARXFP1

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
US-10464929-B2 Organic molecules for terahertz tagging applications COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2019-11-05 US claimed
EP-3094621-B1 USE OF N-(PYRIDIN-2-YL)-AMIDE DERIVATIVES FOR TERAHERTZ TAGGING APPLICATIONS COUNCIL SCIENT IND RES (IN) 2019-06-19 EP claimed
EP-3094621-A1 ORGANIC MOLECULES FOR TERAHERTZ TAGGING APPLICATIONS Council of Scientific & Industrial Research (IN) 2016-11-23 EP claimed
US-20160335827-A1 ORGANIC MOLECULES FOR TERAHERTZ TAGGING APPLICATIONS COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2016-11-17 US claimed
WO-2015104722-A1 ORGANIC MOLECULES FOR TERAHERTZ TAGGING APPLICATIONS COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2015-07-16 WO claimed
EP-3392240-B1 USE OF N-(PYRIDIN-2-YL)-AMIDE AND PHENYL-UREA DERIVATIVES FOR TERAHERTZ TAGGING APPLICATIONS COUNCIL SCIENT IND RES (IN) 2020-06-03 EP disclosed
US-10464929-B2 Organic molecules for terahertz tagging applications COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2019-11-05 US disclosed
US-10464929-B2 Organic molecules for terahertz tagging applications COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2019-11-05 US disclosed
EP-3094621-B1 USE OF N-(PYRIDIN-2-YL)-AMIDE DERIVATIVES FOR TERAHERTZ TAGGING APPLICATIONS COUNCIL SCIENT IND RES (IN) 2019-06-19 EP disclosed
EP-3392240-A1 USE OF N-(PYRIDIN-2-YL)-AMIDE AND PHENYL-UREA DERIVATIVES FOR TERAHERTZ TAGGING APPLICATIONS Council Of Scientific & Industrial Research (IN) 2018-10-24 EP disclosed
EP-3094621-A1 ORGANIC MOLECULES FOR TERAHERTZ TAGGING APPLICATIONS Council of Scientific & Industrial Research (IN) 2016-11-23 EP disclosed
US-20160335827-A1 ORGANIC MOLECULES FOR TERAHERTZ TAGGING APPLICATIONS COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2016-11-17 US disclosed
US-20160335827-A1 ORGANIC MOLECULES FOR TERAHERTZ TAGGING APPLICATIONS COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2016-11-17 US disclosed
US-20160335827-A1 ORGANIC MOLECULES FOR TERAHERTZ TAGGING APPLICATIONS COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2016-11-17 US disclosed
WO-2015104722-A1 ORGANIC MOLECULES FOR TERAHERTZ TAGGING APPLICATIONS COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2015-07-16 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 (2 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-20160335827-A1 ORGANIC MOLECULES FOR TERAHERTZ TAGGING APPLICATIONS WIZ, CRYZ, NAA15 KMT2A 1560/4885MEN1 2255/4885SIRT1 1258/4885
US-10464929-B2 Organic molecules for terahertz tagging applications WIZ, CRYZ, NAA15 KMT2A 1560/4885MEN1 2255/4885SIRT1 1258/4885

“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.