SCHEMBL22016999

SCHEMBL22016999

N#Cc1ccc(-c2c(-n3c4ccc(-c5ccccc5)cc4c4cc(-c5ccccc5)ccc43)c(-n3c4ccccc4c4ccccc43)c(-n3c4ccc(-c5ccccc5)cc4c4cc(-c5ccccc5)ccc43)c(-n3c4ccccc4c4ccccc43)c2-n2c3ccc(-c4ccccc4)cc3c3cc(-c4ccccc4)ccc32)cc1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 2/20 0.39
GABRA1 P14867 1/20 0.38
GABRG2 P18507 1/20 0.38
GABRB3 P28472 1/20 0.38
GABRA5 P31644 1/20 0.38
GABRA3 P34903 1/20 0.38
TSPO P30536 1/20 0.38
RORC P51449 7/20 0.37
ALDH1A3 P47895 1/20 0.36
AR P10275 1/20 0.35
MAP4K4 O95819 1/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
ATM Q13315 1/20 0.34
ENPP3 O14638 1/20 0.34
KAT6A Q92794 1/20 0.34

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
SCHEMBL22454887 1.00 PTGER4 (0.39) PTGER4GABRA1GABRG2GABRB3GABRA5
SCHEMBL22017018 1.00 PTGER4 (0.39) PTGER4GABRA1GABRG2GABRB3GABRA5
SCHEMBL22454880 1.00 PTGER4 (0.39) PTGER4GABRA1GABRG2GABRB3GABRA5
SCHEMBL22016998 1.00 PTGER4 (0.39) PTGER4GABRA1GABRG2GABRB3GABRA5
SCHEMBL24509883 0.92 ATM (0.45) PTGER4RORCARMEN1KMT2A
SCHEMBL24509806 0.92 ATM (0.45) PTGER4RORCARMEN1KMT2A
SCHEMBL24509797 0.92 ATM (0.45) PTGER4RORCARMEN1KMT2A
SCHEMBL22458153 0.92 ATM (0.45) PTGER4RORCARMEN1KMT2A
SCHEMBL22016732 0.92 TSPO (0.38) PTGER4GABRA1GABRG2GABRB3GABRA5
SCHEMBL22017000 0.92 TSPO (0.38) PTGER4GABRA1GABRG2GABRB3GABRA5

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-20200161562-A1 ORGANIC ELECTROLUMINESCENCE DEVICE AND COMPOUND FOR ORGANIC ELECTROLUMINESCENCE DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2020-05-21 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-20200161562-A1 ORGANIC ELECTROLUMINESCENCE DEVICE AND COMPOUND FOR ORGANIC ELECTROLUMINESCENCE DEVICE EML4, CELF2, L1CAM PTGER4 2489/4885GABRA1 1926/4885GABRG2 2763/4885

“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.