SCHEMBL19087023

SCHEMBL19087023

CCCCCCCNCC1CCOCC1

nearest known ligand 0.62

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GNAI3 P08754 2/20 0.62
GNAO1 P09471 2/20 0.62
GNAI1 P63096 2/20 0.62
SAT1 P21673 1/20 0.48
ALDH1A1 P00352 1/20 0.43
TSHR P16473 1/20 0.43
S1PR2 O95136 5/20 0.38
S1PR4 O95977 5/20 0.38
S1PR1 P21453 5/20 0.38
S1PR3 Q99500 5/20 0.38
S1PR5 Q9H228 1/20 0.38
MEN1 O00255 1/20 0.38
HTT P42858 1/20 0.38
KMT2A Q03164 1/20 0.38
NAAA Q02083 1/20 0.38
EPHX1 P07099 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
SCHEMBL25590629 1.00 GNAI3 (0.62) GNAI3GNAO1GNAI1SAT1ALDH1A1
SCHEMBL23219671 0.89 GNAI3 (0.54) GNAI3GNAO1GNAI1SAT1ALDH1A1
SCHEMBL19414059 0.86 GNAI3 (0.72) GNAI3GNAO1GNAI1SAT1ALDH1A1
SCHEMBL1678448 0.86 GNAI3 (0.72) GNAI3GNAO1GNAI1SAT1ALDH1A1
SCHEMBL17718455 0.86 GNAI3 (0.72) GNAI3GNAO1GNAI1SAT1ALDH1A1
SCHEMBL11541786 0.86 GNAI3 (0.72) GNAI3GNAO1GNAI1SAT1ALDH1A1
SCHEMBL1933069 0.86 GNAI3 (0.72) GNAI3GNAO1GNAI1SAT1ALDH1A1
SCHEMBL7767956 0.86 GNAI3 (0.72) GNAI3GNAO1GNAI1SAT1ALDH1A1
SCHEMBL11539085 0.86 GNAI3 (0.72) GNAI3GNAO1GNAI1SAT1ALDH1A1
SCHEMBL23468533 0.84 GNAI3 (0.70) GNAI3GNAO1GNAI1SAT1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 (1 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-20170190689-A1 PYRIDINE AND PYRIDIMINE COMPOUNDS AS PI3K-GAMMA INHIBITORS PIK3CG, PIK3CD, PIK3CB GNAI3 274/4885GNAO1 1195/4885GNAI1 216/4885

“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.