SCHEMBL21665622

SCHEMBL21665622

c1ccc2c(c1)-c1ccccc1C21c2ccccc2-c2c(Nc3ccc4sc5ccccc5c4c3)cccc21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 1/20 0.42
MAPT P10636 5/20 0.41
PARP14 Q460N5 1/20 0.36
GPR3 P46089 1/20 0.34
TDO2 P48775 2/20 0.34
DHODH Q02127 1/20 0.34
ALDH1A1 P00352 3/20 0.33
HPGD P15428 2/20 0.33
RAB9A P51151 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
POLB P06746 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ALOX5 P09917 1/20 0.33
IDO1 P14902 6/20 0.32
KDM4E B2RXH2 2/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
EGFR P00533 1/20 0.31
NPC1 O15118 1/20 0.31

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
SCHEMBL21665688 0.93 MAPT (0.39) PTGIRMAPTPARP14GPR3TDO2
SCHEMBL22680496 0.92 PTGIR (0.40) PTGIRMAPTPARP14GPR3TDO2
SCHEMBL21665489 0.86 RIPK2 (0.36) PTGIREGFRPDK2
SCHEMBL21665631 0.85 ALOX5 (0.44) MAPTPARP14TDO2TDP1ALOX5
SCHEMBL22245911 0.85 MAPT (0.37) PTGIRMAPTPARP14GPR3TDO2
SCHEMBL19221261 0.84 MAPK14 (0.35) MAPTALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL22891409 0.84 MAPT (0.35) PTGIRMAPTPARP14TDO2ALDH1A1
SCHEMBL21665618 0.83 ALOX5 (0.43) PARP14TDO2ALOX5IDO1EGFR
SCHEMBL18729082 0.83 PTGIR (0.46) PTGIRMAPTGPR3TDO2DHODH
SCHEMBL17742489 0.83 PTGIR (0.46) PTGIRMAPTPARP14GPR3TDO2

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 PTGIR 2798/4885MAPT 1524/4885PARP14 2239/4885

“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.