SCHEMBL22889351

SCHEMBL22889351

c1cc(-c2ccc3ccccc3c2)cc(-c2nc(-c3ccccc3-c3ccc4ccccc4c3)nc(-c3cccc4c3oc3ccccc34)n2)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.48
GGPS1 O95749 1/20 0.39
PRKDC P78527 3/20 0.39
PTGES2 Q9H7Z7 1/20 0.37
CYP1A2 P05177 2/20 0.36
NPC1 O15118 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
RAB9A P51151 1/20 0.36
PIK3CD O00329 1/20 0.35
PIK3CB P42338 1/20 0.35
HSD17B1 P14061 1/20 0.35
HSD17B2 P37059 1/20 0.35
PLA2G2A P14555 1/20 0.35
PLA2G4A P47712 1/20 0.35
PRMT5 O14744 1/20 0.35
WDR77 Q9BQA1 1/20 0.35
ALDH1A1 P00352 3/20 0.35
KDM4E B2RXH2 2/20 0.35
TP53 P04637 2/20 0.35

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
SCHEMBL22889352 0.98 ALOX5 (0.46) ALOX5GGPS1PRKDCPTGES2CYP1A2
SCHEMBL22889221 0.98 ALOX5 (0.45) ALOX5GGPS1PRKDCPTGES2CYP1A2
SCHEMBL22889107 0.96 ALOX5 (0.48) ALOX5GGPS1PRKDCPTGES2CYP1A2
SCHEMBL22889353 0.95 ALOX5 (0.46) ALOX5GGPS1PRKDCPTGES2CYP1A2
SCHEMBL22889231 0.94 ALOX5 (0.47) ALOX5GGPS1PRKDCPTGES2CYP1A2
SCHEMBL22889389 0.94 ALOX5 (0.47) ALOX5GGPS1PRKDCPTGES2CYP1A2
SCHEMBL22889379 0.94 ALOX5 (0.46) ALOX5GGPS1PRKDCPTGES2CYP1A2
SCHEMBL22889401 0.94 ALOX5 (0.46) ALOX5GGPS1PRKDCCYP1A2NPC1
SCHEMBL22888893 0.94 ALOX5 (0.49) ALOX5GGPS1PRKDCPTGES2CYP1A2
SCHEMBL22888579 0.94 ALOX5 (0.53) ALOX5GGPS1PRKDCPTGES2CYP1A2

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-11765972-B2 Compound and organic electroluminescence device using the same IDEMITSU KOSAN CO., LTD. (JP) 2023-09-19 US disclosed
US-11765972-B2 Compound and organic electroluminescence device using the same IDEMITSU KOSAN CO., LTD. (JP) 2023-09-19 US disclosed
US-20210009527-A1 COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME IDEMITSU KOSAN CO.,LTD. (JP) 2021-01-14 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-20210009527-A1 COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME OR10J3, RPS4Y1, AR ALOX5 3163/4885GGPS1 3177/4885PRKDC 4797/4885
US-11765972-B2 Compound and organic electroluminescence device using the same AR, OR10J3, RPS4Y1 ALOX5 3071/4885GGPS1 3231/4885PRKDC 4796/4885

“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.