SCHEMBL20073913

SCHEMBL20073913

Cc1cc(NC(=O)OCC(C)C)ccc1-c1cc(N)n[nH]1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.48
KDM4E B2RXH2 1/20 0.46
KDR P35968 2/20 0.43
LCK P06239 1/20 0.43
HCK P08631 1/20 0.43
SRC P12931 1/20 0.43
LMNA P02545 3/20 0.42
TSHR P16473 2/20 0.42
HTT P42858 2/20 0.42
ALOX15 P16050 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
TNIK Q9UKE5 6/20 0.42
MAPK1 P28482 1/20 0.40
MAPKAPK2 P49137 1/20 0.39
HDAC3 O15379 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC2 Q92769 1/20 0.39
AAK1 Q2M2I8 1/20 0.38
CIT O14578 2/20 0.38
ALDH1A1 P00352 1/20 0.38

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
SCHEMBL20073912 0.86 SMN1; SMN2 (0.47) SMN1; SMN2KDM4EKDRLCKHCK
SCHEMBL20073910 0.84 KDR (0.49) SMN1; SMN2KDRLCKHCKSRC
SCHEMBL20064687 0.81 CA12 (0.44) KDM4EKDRTNIKMAPKAPK2
SCHEMBL12537832 0.71 LMNA (0.62) SMN1; SMN2KDM4ELMNATSHRHTT
SCHEMBL6810771 0.70 SMN1; SMN2 (0.60) SMN1; SMN2KDM4ELMNATSHRHTT
SCHEMBL10192028 0.68 SMN1; SMN2 (0.61) SMN1; SMN2LMNATSHRHTTALOX15
SCHEMBL10191990 0.67 LMNA (0.79) SMN1; SMN2LMNATSHRHTTALOX15
SCHEMBL20073902 0.66 SMN1; SMN2 (0.52) SMN1; SMN2KDM4ELMNATSHRHTT
SCHEMBL2322638 0.66 SMN1; SMN2 (0.61) SMN1; SMN2KDM4ELMNATSHRHTT
SCHEMBL22984233 0.65 SMN1; SMN2 (0.61) SMN1; SMN2KDM4ELMNATSHRHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11084826-B2 RSV antiviral pyrazolo- and triazolo-pyrimidine compounds Janssen Sciences Ireland Unlimited Company (IE) 2021-08-10 US disclosed
US-20200223855-A1 RSV ANTIVIRAL PYRAZOLO- AND TRIAZOLO-PYRIMIDINE COMPOUNDS JANSSEN SCIENCES IRELAND UNLIMITED CO (IE) 2020-07-16 US disclosed
US-20190248793-A1 RSV ANTIVIRAL PYRAZOLO- AND TRIAZOLO-PYRIMIDINE COMPOUNDS Janssen Sciences Ireland Unlimited Company (IE) 2019-08-15 US disclosed
US-10208048-B2 RSV antiviral pyrazolo- and triazolo-pyrimidine compounds JANSSEN SCIENCES IRELAND UC (IE) 2019-02-19 US disclosed
US-20180105529-A1 RSV ANTIVIRAL PYRAZOLO- AND TRIAZOLO-PYRIMIDINE COMPOUNDS JANSSEN SCIENCES IRELAND UC (IE) 2018-04-19 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 (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-10208048-B2 RSV antiviral pyrazolo- and triazolo-pyrimidine compounds ZC3HAV1, MAVS, TYMP SMN1; SMN2 515/4885KDM4E 3598/4885KDR 850/4885
US-20200223855-A1 RSV ANTIVIRAL PYRAZOLO- AND TRIAZOLO-PYRIMIDINE COMPOUNDS ZC3HAV1, MAVS, TYMP SMN1; SMN2 515/4885KDM4E 3598/4885KDR 850/4885
US-11084826-B2 RSV antiviral pyrazolo- and triazolo-pyrimidine compounds ZC3HAV1, MAVS, TYMP SMN1; SMN2 515/4885KDM4E 3598/4885KDR 850/4885
US-20180105529-A1 RSV ANTIVIRAL PYRAZOLO- AND TRIAZOLO-PYRIMIDINE COMPOUNDS ZC3HAV1, MAVS, TYMP SMN1; SMN2 515/4885KDM4E 3598/4885KDR 850/4885
US-20190248793-A1 RSV ANTIVIRAL PYRAZOLO- AND TRIAZOLO-PYRIMIDINE COMPOUNDS ZC3HAV1, MAVS, TYMP SMN1; SMN2 515/4885KDM4E 3598/4885KDR 850/4885

“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.