SCHEMBL20005809

SCHEMBL20005809

CCCCc1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 2/20 0.47
KDM4E B2RXH2 2/20 0.42
ATM Q13315 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
EP300 Q09472 1/20 0.42
KAT2A Q92830 1/20 0.42
KAT2B Q92831 1/20 0.42
RARB P10826 1/20 0.40
UCHL3 P15374 1/20 0.39
DHODH Q02127 1/20 0.39
CTSV O60911 1/20 0.38
CTSL P07711 1/20 0.38
KEAP1 Q14145 1/20 0.38
NFE2L2 Q16236 1/20 0.38
CNR1 P21554 1/20 0.38
CNR2 P34972 1/20 0.38
IL1R1 P14778 1/20 0.37
TLR7 Q9NYK1 1/20 0.37
ALDH1A1 P00352 1/20 0.37
CYP1A2 P05177 1/20 0.37

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
SCHEMBL13932493 0.97 HSD11B1 (0.43) HSD11B1KDM4EATML3MBTL1EP300
SCHEMBL10042901 0.93 KDM4E (0.44) HSD11B1KDM4EATML3MBTL1KAT2B
SCHEMBL13932488 0.93 KDM4E (0.44) HSD11B1KDM4EATML3MBTL1KAT2B
SCHEMBL24004264 0.92 RORA (0.41) HSD11B1KDM4EATML3MBTL1EP300
SCHEMBL20005862 0.92 TSPO (0.46) HSD11B1KDM4EATML3MBTL1EP300
SCHEMBL10042900 0.92 TSPO (0.46) HSD11B1KDM4EATML3MBTL1EP300
SCHEMBL13932498 0.90 RORA (0.41) HSD11B1KDM4EATML3MBTL1EP300
SCHEMBL24004283 0.89 KDM4E (0.41) HSD11B1KDM4EATML3MBTL1EP300
SCHEMBL18231556 0.89 TSPO (0.41) HSD11B1KDM4EATML3MBTL1EP300
SCHEMBL24004523 0.88 HSD11B1 (0.43) HSD11B1EP300KAT2AKAT2BRARB

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-20180090687-A1 CROSS-CONJUGATED POLYMER, MATERIAL FOR ELECTRONIC ELEMENT, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, AND ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO., LTD (JP) 2018-03-29 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-20180090687-A1 CROSS-CONJUGATED POLYMER, MATERIAL FOR ELECTRONIC ELEMENT, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, AND ORGANIC ELECTROLUMINESCENT ELEMENT SLC18A1, SLC1A2, SLC43A1 HSD11B1 3865/4885KDM4E 1587/4885ATM 3732/4885

“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.