SCHEMBL21149104

SCHEMBL21149104

c1ccc(-c2nc(-c3ccc(-c4ccc5c6ccccc6c6ccccc6c5c4)cc3)nc(-c3cccc(-c4cccc5sc6ccccc6c45)c3)n2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIMK1 P53667 2/20 0.36
F9 P00740 1/20 0.35
ALOX5 P09917 1/20 0.35
PIM3 Q86V86 2/20 0.35
MAP3K8 P41279 3/20 0.34
ADORA2A P29274 1/20 0.33
ADORA1 P30542 1/20 0.33
PIM1 P11309 1/20 0.33
ALDH1A1 P00352 2/20 0.33
MAPT P10636 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
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
ALK Q9UM73 1/20 0.32
ROCK1 Q13464 1/20 0.32
SLC9A1 P19634 1/20 0.32
KDM4E B2RXH2 1/20 0.32

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
SCHEMBL26573612 0.99 LIMK1 (0.36) LIMK1F9ALOX5PIM3MAP3K8
SCHEMBL24169292 0.99 LIMK1 (0.36) LIMK1F9ALOX5PIM3MAP3K8
SCHEMBL21148487 0.99 LIMK1 (0.36) LIMK1F9ALOX5PIM3MAP3K8
SCHEMBL21149210 0.98 F9 (0.38) LIMK1F9ALOX5PIM3MAP3K8
SCHEMBL22876411 0.96 PIM3 (0.37) LIMK1F9ALOX5PIM3MAP3K8
SCHEMBL21755954 0.96 LIMK1 (0.35) LIMK1F9ALOX5PIM3MAP3K8
SCHEMBL24169537 0.96 LIMK1 (0.38) LIMK1F9ALOX5PIM3ADORA2A
SCHEMBL24169849 0.96 LIMK1 (0.38) LIMK1F9ALOX5PIM3ADORA2A
SCHEMBL20391968 0.95 LIMK1 (0.36) LIMK1F9ALOX5PIM3MAP3K8
SCHEMBL21147386 0.95 LIMK1 (0.39) LIMK1F9ALOX5PIM3MAP3K8

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-20230329097-A1 COMPOSITION FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC OPTOELECTRONIC DEVICE, AND DISPLAY DEVICE SAMSUNG SDI CO LTD (KR) 2023-10-12 US disclosed
US-20230329097-A1 COMPOSITION FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC OPTOELECTRONIC DEVICE, AND DISPLAY DEVICE SAMSUNG SDI CO LTD (KR) 2023-10-12 US disclosed
US-20190214573-A1 COMPOSITION FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC OPTOELECTRONIC DEVICE, AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2019-07-11 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-20190214573-A1 COMPOSITION FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC OPTOELECTRONIC DEVICE, AND DISPLAY DEVICE OR10J3, OCIAD2, OCIAD1 LIMK1 133/4885F9 479/4885ALOX5 306/4885
US-20230329097-A1 COMPOSITION FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC OPTOELECTRONIC DEVICE, AND DISPLAY DEVICE OR10J3, OCIAD2, OCIAD1 LIMK1 133/4885F9 479/4885ALOX5 306/4885

“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.