SCHEMBL26536408

SCHEMBL26536408

O=[N+]([O-])c1cc(-c2cc(-c3ccccc3)cc(-c3ccccc3)c2)ccc1-c1cccc2c1sc1ccccc12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 1/20 0.45
▸ CRHBP P24387 1/20 0.43
▸ CRHR2 Q13324 1/20 0.43
▸ PARP14 Q460N5 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ THRB P10828 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ TNKS O95271 1/20 0.37
▸ TNKS2 Q9H2K2 1/20 0.37
▸ PRKDC P78527 3/20 0.36
▸ EIF4E P06730 3/20 0.36
▸ HPRT1 P00492 1/20 0.36
▸ ERN1 O75460 1/20 0.35
▸ PIK3CD O00329 1/20 0.35
▸ BRD4 O60885 1/20 0.35
▸ PIK3CA P42336 1/20 0.35
▸ PIK3CB P42338 1/20 0.35
▸ MTOR P42345 1/20 0.35
▸ PIK3CG P48736 1/20 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
SCHEMBL14653421 0.98 ALOX5 (0.47) ALOX5CRHBPCRHR2PARP14ALDH1A1
SCHEMBL26549518 0.88 ALOX5 (0.41) ALOX5CRHBPCRHR2PARP14ALDH1A1
SCHEMBL26536378 0.85 ALOX5 (0.41) ALOX5CRHBPCRHR2PARP14ALDH1A1
SCHEMBL17207336 0.83 CRHBP (0.40) CRHBPCRHR2ALDH1A1TDP1THRB
SCHEMBL26536499 0.83 CRHBP (0.41) CRHBPCRHR2ALDH1A1TDP1THRB
SCHEMBL4554345 0.82 PARP14 (0.49) ALOX5PARP14ALDH1A1TDP1MAPT
SCHEMBL4554339 0.81 PARP14 (0.42) ALOX5PARP14ALDH1A1MAPTPRKDC
SCHEMBL10043646 0.81 PARP14 (0.42) ALOX5PARP14ALDH1A1TDP1PRKDC
SCHEMBL14653418 0.81 PARP14 (0.42) ALOX5PARP14ALDH1A1TDP1MAPT
SCHEMBL25118643 0.80 ALOX5 (0.61) ALOX5PARP14ALDH1A1THRBMAPT

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-20230322802-A1 LIGHT EMITTING DEVICE AND FUSED POLYCYCLIC COMPOUND FOR THE LIGHT EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2023-10-12 — — US disclosed
US-20230322802-A1 LIGHT EMITTING DEVICE AND FUSED POLYCYCLIC COMPOUND FOR THE LIGHT EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2023-10-12 — — 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-20230322802-A1 LIGHT EMITTING DEVICE AND FUSED POLYCYCLIC COMPOUND FOR THE LIGHT EMITTING DEVICE CRY1, LAGE3, CRY2 ALOX5 3627/4885CRHBP 3354/4885CRHR2 1261/4885

“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.

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