SCHEMBL21665631

SCHEMBL21665631

c1cc(Nc2cccc3c2-c2ccccc2C32c3ccccc3-c3ccccc32)cc(-c2cccc3c2sc2ccccc23)c1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.44
PARP14 Q460N5 1/20 0.40
TDO2 P48775 3/20 0.34
PRKDC P78527 3/20 0.33
EGFR P00533 1/20 0.32
IDO1 P14902 3/20 0.32
TNKS O95271 1/20 0.30
TNKS2 Q9H2K2 1/20 0.30
SIRT2 Q8IXJ6 1/20 0.30
SIRT1 Q96EB6 1/20 0.30
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
GLA P06280 1/20 0.30
GAA P10253 1/20 0.30
MAPT P10636 1/20 0.30
RECQL P46063 1/20 0.30
KMT2A Q03164 1/20 0.30
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL21665618 0.98 ALOX5 (0.43) ALOX5PARP14TDO2PRKDCEGFR
SCHEMBL21446520 0.88 ALOX5 (0.44) ALOX5PARP14TDO2PRKDCEGFR
SCHEMBL21615055 0.87 TDO2 (0.33) ALOX5TDO2IDO1SIRT2SIRT1
SCHEMBL21665622 0.85 PTGIR (0.42) ALOX5PARP14TDO2EGFRIDO1
SCHEMBL21665688 0.83 MAPT (0.39) ALOX5PARP14TDO2IDO1KDM4E
SCHEMBL21168544 0.82 ALOX5 (0.53) ALOX5PARP14PRKDCTNKSTNKS2
SCHEMBL26687661 0.82 ALOX5 (0.41) ALOX5PARP14PRKDCKDM4EMEN1
SCHEMBL17855950 0.82 ALOX5 (0.41) ALOX5PARP14TDO2PRKDCIDO1
SCHEMBL21665678 0.82 FADS1 (0.42) SIRT2SIRT1KDM4EMEN1GLA
SCHEMBL27383945 0.81 ALOX5 (0.52) ALOX5PARP14TDO2PRKDCEGFR

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 ALOX5 946/4885PARP14 2239/4885TDO2 1974/4885

“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.