SCHEMBL21149136

SCHEMBL21149136

c1ccc(-c2ccc(-c3nc(-c4cccc(-c5ccc6sc7ccccc7c6c5)c4)nc(-c4cccc(-c5cccc6sc7ccccc7c56)c4)n3)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM3 Q86V86 2/20 0.40
ALOX5 P09917 1/20 0.38
LIMK1 P53667 2/20 0.36
MAP3K8 P41279 3/20 0.34
CYP1A2 P05177 1/20 0.34
ROCK1 Q13464 1/20 0.34
GPR3 P46089 1/20 0.34
ADORA2A P29274 1/20 0.33
ADORA1 P30542 1/20 0.33
PIM1 P11309 1/20 0.33
F9 P00740 1/20 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
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
KMT2A Q03164 1/20 0.33
ALK Q9UM73 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
SCHEMBL21148571 1.00 PIM3 (0.40) PIM3ALOX5LIMK1MAP3K8CYP1A2
SCHEMBL21149149 0.99 ALOX5 (0.39) PIM3ALOX5LIMK1MAP3K8CYP1A2
SCHEMBL21148734 0.98 PIM3 (0.40) PIM3ALOX5LIMK1MAP3K8CYP1A2
SCHEMBL21148602 0.98 PIM3 (0.40) PIM3ALOX5LIMK1MAP3K8CYP1A2
SCHEMBL22760320 0.95 ALOX5 (0.36) PIM3ALOX5LIMK1MAP3K8CYP1A2
SCHEMBL26080438 0.95 PIM3 (0.40) PIM3ALOX5LIMK1MAP3K8CYP1A2
SCHEMBL22876151 0.95 PIM3 (0.40) PIM3ALOX5LIMK1MAP3K8CYP1A2
SCHEMBL21148603 0.95 ALOX5 (0.39) PIM3ALOX5LIMK1CYP1A2GPR3
SCHEMBL21149178 0.95 PIM3 (0.39) PIM3ALOX5LIMK1CYP1A2ROCK1
SCHEMBL21147386 0.95 LIMK1 (0.39) PIM3ALOX5LIMK1MAP3K8GPR3

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 PIM3 3857/4885ALOX5 306/4885LIMK1 133/4885
US-20230329097-A1 COMPOSITION FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC OPTOELECTRONIC DEVICE, AND DISPLAY DEVICE OR10J3, OCIAD2, OCIAD1 PIM3 3857/4885ALOX5 306/4885LIMK1 133/4885

“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.