SCHEMBL20064697

SCHEMBL20064697

CCOC(=O)c1cc(CC)n2nc(-c3ccc4[nH]ccc4c3)cc2n1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.43
HSD17B10 Q99714 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
KDM4E B2RXH2 2/20 0.43
HPGD P15428 2/20 0.43
ALDH1A1 P00352 1/20 0.43
TSHR P16473 1/20 0.43
CASP1 P29466 1/20 0.43
CCNC P24863 1/20 0.41
CDK8 P49336 1/20 0.41
NPC1 O15118 3/20 0.41
RAB9A P51151 3/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
MAOA P21397 1/20 0.41
MMP2 P08253 1/20 0.40
MMP13 P45452 1/20 0.40
MMP14 P50281 1/20 0.40
KDR P35968 2/20 0.40
DYRK3 O43781 1/20 0.39

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
SCHEMBL20064792 0.88 DRD5 (0.42) KDM4EALDH1A1CCNCCDK8NPC1
SCHEMBL20073919 0.87 MAPT (0.43) MAPTHSD17B10SMN1; SMN2KDM4EHPGD
SCHEMBL20064699 0.84 MAPT (0.42) MAPTHSD17B10SMN1; SMN2KDM4EHPGD
SCHEMBL20064720 0.83 MAPT (0.59) MAPTHSD17B10SMN1; SMN2KDM4EHPGD
SCHEMBL18198477 0.82 MAPT (0.45) MAPTHSD17B10SMN1; SMN2KDM4EHPGD
SCHEMBL18198346 0.82 MAPT (0.47) MAPTHSD17B10SMN1; SMN2KDM4EHPGD
SCHEMBL20064682 0.82 MAPT (0.45) MAPTHSD17B10SMN1; SMN2KDM4EHPGD
SCHEMBL20064698 0.82 MAPT (0.41) MAPTHSD17B10SMN1; SMN2KDM4EHPGD
SCHEMBL20064708 0.81 MAPT (0.45) MAPTHSD17B10SMN1; SMN2KDM4EHPGD
SCHEMBL20064726 0.81 NPC1 (0.53) MAPTHSD17B10SMN1; SMN2KDM4EHPGD

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 6 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
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 MAPT 3325/4885HSD17B10 4623/4885SMN1; SMN2 515/4885
US-20200223855-A1 RSV ANTIVIRAL PYRAZOLO- AND TRIAZOLO-PYRIMIDINE COMPOUNDS ZC3HAV1, MAVS, TYMP MAPT 3325/4885HSD17B10 4623/4885SMN1; SMN2 515/4885
US-11084826-B2 RSV antiviral pyrazolo- and triazolo-pyrimidine compounds ZC3HAV1, MAVS, TYMP MAPT 3325/4885HSD17B10 4623/4885SMN1; SMN2 515/4885
US-20180105529-A1 RSV ANTIVIRAL PYRAZOLO- AND TRIAZOLO-PYRIMIDINE COMPOUNDS ZC3HAV1, MAVS, TYMP MAPT 3325/4885HSD17B10 4623/4885SMN1; SMN2 515/4885
US-20190248793-A1 RSV ANTIVIRAL PYRAZOLO- AND TRIAZOLO-PYRIMIDINE COMPOUNDS ZC3HAV1, MAVS, TYMP MAPT 3325/4885HSD17B10 4623/4885SMN1; SMN2 515/4885

“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.