SCHEMBL20064762

SCHEMBL20064762

CCc1cc(C(=O)O)nc2cc(-c3ccccc3F)nn12

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 5/20 0.42
ADORA3 P0DMS8 5/20 0.42
ADORA1 P30542 4/20 0.42
ADORA2B P29275 1/20 0.42
MAPT P10636 2/20 0.41
TP53 P04637 1/20 0.41
KDM4E B2RXH2 3/20 0.41
ALDH1A1 P00352 2/20 0.41
HSD17B10 Q99714 2/20 0.40
POLB P06746 1/20 0.40
ABCB1 P08183 1/20 0.39
GLA P06280 1/20 0.37
HPGD P15428 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37

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
SCHEMBL20064696 0.87 HPGD (0.48) ADORA2AADORA3ADORA1ADORA2BMAPT
SCHEMBL20064748 0.86 DPP4 (0.43) MAPTTP53KDM4EALDH1A1
SCHEMBL18198351 0.85 MCL1 (0.36) MAPTTP53KDM4EALDH1A1HSD17B10
SCHEMBL20064800 0.84 KDM4E (0.35) MAPTTP53KDM4EALDH1A1HSD17B10
SCHEMBL18198326 0.84 KDM4E (0.36) MAPTKDM4EALDH1A1HSD17B10POLB
SCHEMBL20064752 0.82 ALDH1A1 (0.38) MAPTTP53KDM4EALDH1A1
SCHEMBL20064763 0.82 ABCB1 (0.39) MAPTTP53KDM4EALDH1A1HSD17B10
SCHEMBL20064794 0.81 MET (0.42)
SCHEMBL20065181 0.80 ADORA2A (0.35) ADORA2AADORA3ADORA1ADORA2BMAPT
SCHEMBL20065179 0.80 TSPO (0.36) ADORA2AADORA3ADORA1ADORA2BMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3288942-B1 RSV ANTIVIRAL PYRAZOLO- AND TRIAZOLO-PYRIMIDINE COMPOUNDS JANSSEN SCIENCES IRELAND UNLIMITED CO (IE) 2021-10-27 EP disclosed
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 ADORA2A 1067/4885ADORA3 578/4885ADORA1 733/4885
US-20200223855-A1 RSV ANTIVIRAL PYRAZOLO- AND TRIAZOLO-PYRIMIDINE COMPOUNDS ZC3HAV1, MAVS, TYMP ADORA2A 1067/4885ADORA3 578/4885ADORA1 733/4885
US-11084826-B2 RSV antiviral pyrazolo- and triazolo-pyrimidine compounds ZC3HAV1, MAVS, TYMP ADORA2A 1067/4885ADORA3 578/4885ADORA1 733/4885
US-20180105529-A1 RSV ANTIVIRAL PYRAZOLO- AND TRIAZOLO-PYRIMIDINE COMPOUNDS ZC3HAV1, MAVS, TYMP ADORA2A 1067/4885ADORA3 578/4885ADORA1 733/4885
US-20190248793-A1 RSV ANTIVIRAL PYRAZOLO- AND TRIAZOLO-PYRIMIDINE COMPOUNDS ZC3HAV1, MAVS, TYMP ADORA2A 1067/4885ADORA3 578/4885ADORA1 733/4885

“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.