SCHEMBL20005862

SCHEMBL20005862

CCCCc1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSPO P30536 4/20 0.46
HSD11B1 P28845 2/20 0.42
EP300 Q09472 1/20 0.41
KAT2A Q92830 1/20 0.41
KAT2B Q92831 1/20 0.41
KDM4E B2RXH2 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
ATM Q13315 1/20 0.41
DHODH Q02127 1/20 0.38
CTSV O60911 1/20 0.37
CTSL P07711 1/20 0.37
ICMT O60725 1/20 0.37
PTGER4 P35408 1/20 0.37
RARB P10826 1/20 0.36
PLA2G4A P47712 1/20 0.36
IL1R1 P14778 1/20 0.36
ALDH1A1 P00352 2/20 0.36
CYP1A2 P05177 1/20 0.36
GLA P06280 1/20 0.36
CYP3A4 P08684 1/20 0.36

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
SCHEMBL10042900 1.00 TSPO (0.46) TSPOHSD11B1EP300KAT2AKAT2B
SCHEMBL24004283 0.95 KDM4E (0.41) TSPOHSD11B1EP300KAT2AKAT2B
SCHEMBL11887556 0.93 TSPO (0.45) TSPOHSD11B1EP300KAT2AKAT2B
SCHEMBL18231556 0.92 TSPO (0.41) TSPOHSD11B1EP300KAT2AKAT2B
SCHEMBL20005809 0.92 HSD11B1 (0.47) TSPOHSD11B1EP300KAT2AKAT2B
SCHEMBL11887552 0.92 L3MBTL1 (0.46) TSPOKDM4EL3MBTL1ATMPTGER4
SCHEMBL25785321 0.91 TSPO (0.42) TSPOHSD11B1EP300KAT2AKAT2B
SCHEMBL24004264 0.91 RORA (0.41) TSPOHSD11B1EP300KAT2AKAT2B
SCHEMBL25810829 0.91 TSPO (0.45) TSPOHSD11B1EP300KAT2AKAT2B
SCHEMBL25810727 0.91 EP300 (0.45) TSPOHSD11B1EP300KAT2AKAT2B

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 TSPO 225/4885HSD11B1 3865/4885EP300 1837/4885

“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.