SCHEMBL21187012

SCHEMBL21187012

c1ccc(-c2ccc(-c3nc(-c4cccc(-c5ccccc5)c4)nc(-c4ccc5c(c4)c4ccccc4c4ccc6c7ccccc7sc6c45)n3)cc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LIMK1 P53667 3/20 0.39
▸ ALOX5 P09917 1/20 0.39
▸ TNKS O95271 1/20 0.36
▸ TNKS2 Q9H2K2 1/20 0.36
▸ PIM3 Q86V86 2/20 0.36
▸ MAPT P10636 3/20 0.35
▸ PIM1 P11309 2/20 0.35
▸ PIM2 Q9P1W9 2/20 0.35
▸ ADORA2A P29274 1/20 0.34
▸ ADORA1 P30542 1/20 0.34
▸ MEN1 O00255 3/20 0.33
▸ KMT2A Q03164 3/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ HPGD P15428 2/20 0.33
▸ PIK3CA P42336 1/20 0.33
▸ PI4KA P42356 1/20 0.33
▸ PI4KB Q9UBF8 1/20 0.33
▸ ROCK1 Q13464 1/20 0.33
▸ ATM Q13315 2/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL21186733 1.00 LIMK1 (0.39) LIMK1ALOX5TNKSTNKS2PIM3
SCHEMBL21186734 1.00 LIMK1 (0.39) LIMK1ALOX5TNKSTNKS2PIM3
SCHEMBL21187068 1.00 LIMK1 (0.39) LIMK1ALOX5TNKSTNKS2PIM3
SCHEMBL21186845 1.00 LIMK1 (0.39) LIMK1ALOX5TNKSTNKS2PIM3
SCHEMBL21186975 0.99 ALOX5 (0.39) LIMK1ALOX5TNKSTNKS2PIM3
SCHEMBL21186844 0.99 ALOX5 (0.39) LIMK1ALOX5TNKSTNKS2PIM3
SCHEMBL21187067 0.99 LIMK1 (0.40) LIMK1ALOX5TNKSTNKS2PIM3
SCHEMBL25557626 0.97 LIMK1 (0.39) LIMK1ALOX5TNKSTNKS2PIM3
SCHEMBL25557627 0.96 ALOX5 (0.39) LIMK1ALOX5TNKSTNKS2PIM3
SCHEMBL22096964 0.96 LIMK1 (0.39) LIMK1ALOX5TNKSTNKS2PIM3

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-10944059-B2 Compound for organic optoelectronic device, organic optoelectronic device, and display device SAMSUNG SDI CO., LTD. (KR) 2021-03-09 — — US disclosed
US-20190229275-A1 COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC OPTOELECTRONIC DEVICE, AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2019-07-25 — — 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-20190229275-A1 COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC OPTOELECTRONIC DEVICE, AND DISPLAY DEVICE OXER1, OR10J3, OCIAD1 LIMK1 165/4885ALOX5 393/4885TNKS 4330/4885
US-10944059-B2 Compound for organic optoelectronic device, organic optoelectronic device, and display device OXER1, OR10J3, OCIAD1 LIMK1 165/4885ALOX5 393/4885TNKS 4330/4885

“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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