SCHEMBL21148196

SCHEMBL21148196

c1ccc(-c2cccc(-c3nc(-c4cccc(-c5cccc6sc7ccccc7c56)c4)nc(-c4cccc(-c5cccc6sc7ccccc7c56)c4)n3)c2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIMK1 P53667 1/20 0.40
MAP3K8 P41279 4/20 0.39
F9 P00740 1/20 0.37
ALOX5 P09917 1/20 0.37
GPR3 P46089 1/20 0.36
GP6 Q9HCN6 1/20 0.36
BRDT Q58F21 1/20 0.35
ADORA2A P29274 1/20 0.35
ADORA1 P30542 1/20 0.35
PIK3CA P42336 1/20 0.34
PI4KA P42356 1/20 0.34
PI4KB Q9UBF8 1/20 0.34
PIM3 Q86V86 1/20 0.34
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
TP53 P04637 1/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
TSHR P16473 1/20 0.33
NFKB1 P19838 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
SCHEMBL21148223 0.99 LIMK1 (0.39) LIMK1MAP3K8F9ALOX5GPR3
SCHEMBL21147386 0.97 LIMK1 (0.39) LIMK1MAP3K8F9ALOX5GPR3
SCHEMBL25645669 0.97 LIMK1 (0.39) LIMK1MAP3K8F9ALOX5GPR3
SCHEMBL21148706 0.97 LIMK1 (0.39) LIMK1MAP3K8F9ALOX5GPR3
SCHEMBL19196590 0.97 LIMK1 (0.40) LIMK1MAP3K8F9ALOX5GPR3
SCHEMBL26503665 0.96 LIMK1 (0.40) LIMK1MAP3K8F9ALOX5ADORA2A
SCHEMBL21148194 0.96 LIMK1 (0.39) LIMK1MAP3K8F9ALOX5GPR3
SCHEMBL21148226 0.96 LIMK1 (0.39) LIMK1MAP3K8F9ALOX5GPR3
SCHEMBL21148707 0.96 LIMK1 (0.39) LIMK1MAP3K8F9ALOX5GPR3
SCHEMBL25645676 0.96 LIMK1 (0.39) LIMK1MAP3K8F9ALOX5GPR3

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-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 133/4885MAP3K8 1476/4885F9 479/4885
US-20230329097-A1 COMPOSITION FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC OPTOELECTRONIC DEVICE, AND DISPLAY DEVICE OR10J3, OCIAD2, OCIAD1 LIMK1 133/4885MAP3K8 1476/4885F9 479/4885

“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.