SCHEMBL22199894

SCHEMBL22199894

c1ccc2c(-c3cccc4c3oc3ccccc34)nc(-n3c4ccccc4c4c5ccccc5c5c6ccccc6sc5c43)nc2c1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 2/20 0.33
PIK3CB P42338 2/20 0.33
PRKDC P78527 2/20 0.33
ALOX5 P09917 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
SCHEMBL19986034 0.95 PIK3CD (0.31) PIK3CDPIK3CBPRKDC
SCHEMBL22012044 0.92
SCHEMBL22708813 0.91 PRKDC (0.33) PIK3CDPIK3CBPRKDCALOX5
SCHEMBL22894090 0.91 NPC1 (0.31)
SCHEMBL17297604 0.90 PRKDC (0.33) PIK3CDPIK3CBPRKDCALOX5
SCHEMBL19961602 0.90 PIK3CD (0.30) PIK3CDPIK3CBPRKDC
SCHEMBL17297378 0.89 PIK3CD (0.33) PIK3CDPIK3CBPRKDCALOX5
SCHEMBL17305624 0.89 PIK3CD (0.33) PIK3CDPIK3CBPRKDCALOX5
SCHEMBL17305639 0.88 PIK3CD (0.32) PIK3CDPIK3CBPRKDC
SCHEMBL22893726 0.88 ESR1 (0.30)

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-20200216392-A1 A PLURALITY OF HOST MATERIALS AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME DUPONT SPECIALTY MATERIALS KOREA LTD. (KR) 2020-07-09 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-20200216392-A1 A PLURALITY OF HOST MATERIALS AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME TERF2, PIEZO1, TERT PIK3CD 1494/4885PIK3CB 2454/4885PRKDC 3658/4885

“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.