SCHEMBL17425680

SCHEMBL17425680

c1ccc(-c2ccc(-c3cccc4c3oc3c(-c5ccc6c7ccccc7c7ccccc7c6c5)cccc34)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.49
PRKDC P78527 10/20 0.43
ALDH1A1 P00352 3/20 0.42
PIK3CD O00329 3/20 0.42
PIK3CA P42336 3/20 0.42
PIK3CB P42338 3/20 0.42
PIK3CG P48736 3/20 0.42
KDM4E B2RXH2 2/20 0.42
BRD4 O60885 2/20 0.42
BRD2 P25440 2/20 0.42
BRD3 Q15059 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
PDE2A O00408 1/20 0.42
PIK3C2A O00443 1/20 0.42
PIK3R2 O00459 1/20 0.42
PIK3C2B O00750 1/20 0.42
PDE5A O76074 1/20 0.42
TP53 P04637 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42

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
SCHEMBL12175731 0.98 ALOX5 (0.50) ALOX5PRKDCALDH1A1PIK3CDPIK3CA
SCHEMBL17425731 0.97 ALOX5 (0.47) ALOX5PRKDCALDH1A1PIK3CDPIK3CA
SCHEMBL17057260 0.97 ALOX5 (0.47) ALOX5PRKDCALDH1A1PIK3CDPIK3CA
SCHEMBL16133302 0.97 ALOX5 (0.49) ALOX5PRKDCALDH1A1PIK3CDPIK3CA
SCHEMBL17057246 0.95 ALOX5 (0.46) ALOX5PRKDCALDH1A1PIK3CDPIK3CA
SCHEMBL17057263 0.95 ALOX5 (0.48) ALOX5PRKDCALDH1A1PIK3CDPIK3CA
SCHEMBL12175648 0.95 ALOX5 (0.48) ALOX5PRKDCALDH1A1PIK3CDPIK3CA
SCHEMBL17057281 0.95 ALOX5 (0.48) ALOX5PRKDCALDH1A1PIK3CDPIK3CA
SCHEMBL17057308 0.95 ALOX5 (0.48) ALOX5PRKDCALDH1A1PIK3CDPIK3CA
SCHEMBL16133306 0.93 ALOX5 (0.47) ALOX5PRKDCALDH1A1PIK3CDPIK3CA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200039971-A1 NOVEL HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING THE SAME LG CHEM, LTD. (KR) 2020-02-06 US disclosed
EP-2966706-A2 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES Universal Display Corporation (US) 2016-01-13 EP 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-20200039971-A1 NOVEL HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING THE SAME CRY1, CRY2, CYP1A1 ALOX5 1016/4885PRKDC 4379/4885ALDH1A1 39/4885

“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.