SCHEMBL15077253

SCHEMBL15077253

Cc1cn2nc([C@@H]3CCCCN3C(=O)c3c(F)cccc3F)cc2nc1N1CC[C@H](C)C1

nearest known ligand 0.53

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 6/20 0.37
GPBAR1 Q8TDU6 2/20 0.36
HCRTR1 O43613 6/20 0.35
HCRTR2 O43614 6/20 0.35

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
SCHEMBL15077261 0.95 GPBAR1 (0.38) GRM5GPBAR1HCRTR1HCRTR2
SCHEMBL16807810 0.93 HCRTR1 (0.38) GPBAR1HCRTR1HCRTR2
SCHEMBL17445050 0.93 GRM5 (0.34) GRM5GPBAR1
SCHEMBL15077270 0.93 GPBAR1 (0.36) GRM5GPBAR1HCRTR1HCRTR2
SCHEMBL15077215 0.92 GRM5 (0.34) GRM5HCRTR1HCRTR2
SCHEMBL15077200 0.91 HCRTR1 (0.40) HCRTR1HCRTR2
SCHEMBL17445011 0.91 HCRTR1 (0.38) GRM5HCRTR1HCRTR2
SCHEMBL17444981 0.91 GRM5 (0.39) GRM5HCRTR1HCRTR2
SCHEMBL19447601 0.91 GRM5 (0.36) GRM5GPBAR1HCRTR1HCRTR2
SCHEMBL15072884 0.91 GRM5 (0.36) GRM5GPBAR1HCRTR1HCRTR2

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-20160235748-A1 PYRAZOLO[1,5-A]PYRIMIDINES AS ANTIVIRAL AGENTS GILEAD SCIENCES, INC. 2016-08-18 US disclosed
US-9278975-B2 Pyrazolo[1,5-A]pyrimidines as antiviral agents GILEAD SCIENCES, INC. (US) 2016-03-08 US disclosed
US-20160045528-A1 COMBINATION THERAPY FOR TREATING A PARAMYXOVIRUS ALIOS BIOPHARMA, INC. 2016-02-18 US disclosed
US-20150166546-A1 PYRAZOLO[1,5-A]PYRIMIDINES AS ANTIVIRAL AGENTS GILEAD SCIENCES, INC. 2015-06-18 US disclosed
US-8946238-B2 Pyrazolo[1,5-A]pyrimidines as antiviral agents GILEAD SCIENCES, INC. (US) 2015-02-03 US disclosed
US-20130164280-A1 PYRAZOLO[1,5-A]PYRIMIDINES AS ANTIVIRAL AGENTS GILEAD SCIENCES, INC. (US) 2013-06-27 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 (4 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-20130164280-A1 PYRAZOLO[1,5-A]PYRIMIDINES AS ANTIVIRAL AGENTS TYMP, ZC3HAV1, TYMS GRM5 2621/4885GPBAR1 2515/4885HCRTR1 4565/4885
US-20160045528-A1 COMBINATION THERAPY FOR TREATING A PARAMYXOVIRUS MAVS, EIF2AK2, SARS1 GRM5 2184/4885GPBAR1 3675/4885HCRTR1 4161/4885
US-20150166546-A1 PYRAZOLO[1,5-A]PYRIMIDINES AS ANTIVIRAL AGENTS TYMP, ZC3HAV1, TYMS GRM5 2621/4885GPBAR1 2515/4885HCRTR1 4565/4885
US-20160235748-A1 PYRAZOLO[1,5-A]PYRIMIDINES AS ANTIVIRAL AGENTS TYMP, ZC3HAV1, TYMS GRM5 2621/4885GPBAR1 2515/4885HCRTR1 4565/4885

“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.