SCHEMBL19087046

SCHEMBL19087046

In1cc(-c2ccnc(-c3ncc(-c4ccccc4)[nH]3)c2)cn1

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 6/20 0.53
SCN2A Q99250 6/20 0.47
HPGDS O60760 7/20 0.45
SMPD3 Q9NY59 1/20 0.38
CYP3A4 P08684 1/20 0.38
BRAF P15056 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
SCHEMBL19065641 0.85 NPY5R (0.53) NPY5RSCN2AHPGDS
SCHEMBL19065340 0.82 NPY5R (0.50) NPY5RSCN2AHPGDSSMPD3CYP3A4
SCHEMBL19065711 0.81 L3MBTL1 (0.54) NPY5RSCN2AHPGDS
SCHEMBL19066083 0.81 NPY5R (0.48) NPY5RSCN2AHPGDSSMPD3CYP3A4
SCHEMBL19065252 0.81 NPY5R (0.48) NPY5RSCN2AHPGDSSMPD3CYP3A4
SCHEMBL19065511 0.80 NPY5R (0.47) NPY5RSCN2AHPGDS
SCHEMBL19065477 0.79 NPY5R (0.46) NPY5RSCN2AHPGDSSMPD3CYP3A4
SCHEMBL19065720 0.78 NPY5R (0.45) NPY5RSCN2AHPGDS
SCHEMBL19065362 0.78 ALK (0.52) NPY5R
SCHEMBL19065354 0.78 NPY5R (0.45) NPY5RSCN2AHPGDS

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-11352340-B2 Pyridine and pyridimine compounds as PI3K-gamma inhibitors INCYTE CORPORATION (US) 2022-06-07 US disclosed
EP-3792256-A1 PYRIDINE AND PYRIDIMINE COMPOUNDS AS PI3K-GAMMA INHIBITORS Incyte Corporation (US) 2021-03-17 EP disclosed
EP-3400221-B1 PYRAZOL / IMIDAZOL SUBSTITUTED PYRIDINES AS PI3K-GAMMA INHIBITORS INCYTE CORP (US) 2020-08-26 EP disclosed
WO-2017120194-A1 PYRIDINE AND PYRIDIMINE COMPOUNDS AS PI3K-GAMMA INHIBITORS INCYTE CORPORATION (US) 2017-07-13 WO disclosed
US-20170190689-A1 PYRIDINE AND PYRIDIMINE COMPOUNDS AS PI3K-GAMMA INHIBITORS INCYTE CORPORATION 2017-07-06 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 (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-11352340-B2 Pyridine and pyridimine compounds as PI3K-gamma inhibitors PIK3CG, PIK3CD, PIK3CB NPY5R 4040/4885SCN2A 1369/4885HPGDS 700/4885
US-20170190689-A1 PYRIDINE AND PYRIDIMINE COMPOUNDS AS PI3K-GAMMA INHIBITORS PIK3CG, PIK3CD, PIK3CB NPY5R 4040/4885SCN2A 1369/4885HPGDS 700/4885

“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.