SCHEMBL21397026

SCHEMBL21397026

N#Cc1cc(-c2ccc(-n3c4ccccc4c4ccccc43)nc2)cc(-n2c3ccccc3c3ccccc32)c1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 1/20 0.41
KDM4E B2RXH2 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
ALDH1A1 P00352 1/20 0.37
ATM Q13315 1/20 0.35
USP30 Q70CQ3 1/20 0.35
PGR P06401 1/20 0.33
METAP2 P50579 1/20 0.33
GRM5 P41594 5/20 0.32
CYP19A1 P11511 1/20 0.32
SMO Q99835 1/20 0.32
GRM4 Q14833 1/20 0.31
PIM1 P11309 1/20 0.31
RIPK1 Q13546 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
SCHEMBL18574642 0.85 KDM4E (0.47) PTGER4KDM4EL3MBTL1ATMPGR
SCHEMBL15945858 0.84 KDM4E (0.46) PTGER4KDM4EL3MBTL1ATMPGR
SCHEMBL24219897 0.83 PTGER4 (0.42) PTGER4KDM4EL3MBTL1ALDH1A1PGR
SCHEMBL29355400 0.83 PTGER4 (0.42) PTGER4KDM4EL3MBTL1ALDH1A1PGR
SCHEMBL16168576 0.83 KDM4E (0.46) PTGER4KDM4EL3MBTL1ATMPGR
SCHEMBL21397042 0.82 GRM5 (0.46) PTGER4KDM4EL3MBTL1ATMPGR
SCHEMBL21397122 0.81 PTGER4 (0.36) PTGER4KDM4EL3MBTL1ALDH1A1ATM
SCHEMBL29457609 0.81 KDM4E (0.46) PTGER4KDM4EL3MBTL1ATMPGR
SCHEMBL18874148 0.81 KDM4E (0.46) PTGER4KDM4EL3MBTL1ATMPGR
SCHEMBL21396752 0.81 PTGER4 (0.38) PTGER4KDM4EL3MBTL1ATMPGR

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3543230-B1 ORGANIC ELECTROLUMINESCENCE DEVICE AND POLYCYCLIC COMPOUND FOR ORGANIC ELECTROLUMINESCENCE DEVICE SAMSUNG DISPLAY CO LTD (KR) 2021-05-05 EP disclosed
US-20190296247-A1 ORGANIC ELECTROLUMINESCENCE DEVICE AND POLYCYCLIC COMPOUND FOR ORGANIC ELECTROLUMINESCENCE DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2019-09-26 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-20190296247-A1 ORGANIC ELECTROLUMINESCENCE DEVICE AND POLYCYCLIC COMPOUND FOR ORGANIC ELECTROLUMINESCENCE DEVICE SLC25A21, SLCO4C1, SLC18A1 PTGER4 2404/4885KDM4E 955/4885L3MBTL1 1378/4885

“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.