SCHEMBL21665679

SCHEMBL21665679

c1ccc(-c2cc(-c3ccccc3)cc(-c3ccc(Nc4cccc5c4-c4ccccc4C54c5ccccc5-c5ccccc54)cc3)c2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MET P08581 4/20 0.39
HGF P14210 2/20 0.39
AKR1C3 P42330 1/20 0.36
PDK2 Q15119 4/20 0.35
MAPK13 O15264 1/20 0.35
MAPK12 P53778 1/20 0.35
MAPK11 Q15759 1/20 0.35
MAPK14 Q16539 1/20 0.35
PTGER4 P35408 1/20 0.35
STK10 O94804 1/20 0.34
SLK Q9H2G2 1/20 0.34
KDM4E B2RXH2 3/20 0.34
MEN1 O00255 3/20 0.34
MAPT P10636 3/20 0.34
KMT2A Q03164 3/20 0.34
GAA P10253 2/20 0.34
GLA P06280 2/20 0.34
TDP1 Q9NUW8 2/20 0.34
RECQL P46063 1/20 0.34
P2RY2 P41231 2/20 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
SCHEMBL29839680 0.96 AKR1C3 (0.39) METHGFAKR1C3PDK2MAPK13
SCHEMBL14681538 0.96 AKR1C3 (0.39) METHGFAKR1C3PDK2MAPK13
SCHEMBL20434444 0.94 AKR1C3 (0.40) METHGFAKR1C3PDK2MAPK13
SCHEMBL19494833 0.93 SIRT2 (0.37) METHGFAKR1C3PDK2MAPK13
SCHEMBL21665630 0.89 SIRT2 (0.45) AKR1C3PDK2STK10SLKKDM4E
SCHEMBL21665488 0.89 SIRT2 (0.45) AKR1C3PDK2STK10SLKKDM4E
SCHEMBL25740808 0.89 PDK2 (0.34) METHGFAKR1C3PDK2MAPK13
SCHEMBL20935632 0.87 AKR1C3 (0.37) METHGFAKR1C3PDK2MAPK13
SCHEMBL15250350 0.87 SIRT2 (0.46) AKR1C3PDK2STK10SLKKDM4E
SCHEMBL15713967 0.87 MAPT (0.39) METHGFAKR1C3PDK2MAPK13

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200039993-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREFOR DUK SAN NEOLUX CO., LTD (KR) 2020-02-06 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-20200039993-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREFOR OR51E2, WEE1, WEE2 MET 2297/4885HGF 3479/4885AKR1C3 3983/4885

“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.