SCHEMBL20174306

SCHEMBL20174306

O=P(c1ccccc1)(c1ccccc1)c1cccc2c1-c1ccccc1C21c2ccccc2-c2oc3ccccc3c21

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 1/20 0.34
PLK3 Q9H4B4 1/20 0.34
NPSR1 Q6W5P4 1/20 0.33
ACHE P22303 1/20 0.30

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
SCHEMBL20174730 0.85 NPSR1 (0.33) NPSR1
SCHEMBL18156762 0.83 CDC14B (0.33)
SCHEMBL16855328 0.83 CDC14B (0.34)
SCHEMBL18156750 0.82 GGPS1 (0.35)
SCHEMBL20184169 0.79 NPSR1 (0.39) NPSR1
SCHEMBL20174309 0.79 NTRK1 (0.31) NTRK1PLK3
SCHEMBL20174739 0.78 NTRK1 (0.40) NTRK1PLK3
SCHEMBL20174690 0.76 PDK2 (0.41) NTRK1PLK3
SCHEMBL17716721 0.76 CA1 (0.34) NTRK1PLK3
SCHEMBL20174556 0.74 NPSR1 (0.30) NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10738034-B2 Spiro compound and organic light-emitting device comprising same LG CHEM, LTD. (KR) 2020-08-11 US disclosed
US-20180141933-A1 SPIRO COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME LG CHEM, LTD. (KR) 2018-05-24 US disclosed
US-20180141933-A1 SPIRO COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME LG CHEM, LTD. (KR) 2018-05-24 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-10738034-B2 Spiro compound and organic light-emitting device comprising same CRY1, NR2E3, ERG NTRK1 4548/4885PLK3 1825/4885NPSR1 3257/4885
US-20180141933-A1 SPIRO COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME CRY1, NR2E3, ERG NTRK1 4548/4885PLK3 1825/4885NPSR1 3257/4885

“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.