SCHEMBL17990780

SCHEMBL17990780

c1ccc(-c2nc(-n3c4ccccc4c4c5c(ccc6c7ccccc7oc65)ccc43)nc3ccccc23)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.41
MAPT P10636 5/20 0.41
HPGD P15428 4/20 0.41
KDM4E B2RXH2 4/20 0.41
NPSR1 Q6W5P4 1/20 0.41
L3MBTL1 Q9Y468 3/20 0.40
LMNA P02545 1/20 0.39
KMT2A Q03164 6/20 0.35
MEN1 O00255 4/20 0.35
CSF1R P07333 1/20 0.35
PDGFRB P09619 1/20 0.35
KIT P10721 1/20 0.35
FLT3 P36888 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
ADORA2A P29274 1/20 0.34
NUDT1 P36639 1/20 0.34
POLB P06746 1/20 0.34
MAPK1 P28482 1/20 0.34
ATM Q13315 1/20 0.34
TDP1 Q9NUW8 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
SCHEMBL16978607 0.95 ALDH1A1 (0.44) ALDH1A1MAPTHPGDKDM4ENPSR1
SCHEMBL31679 0.93 ALDH1A1 (0.42) ALDH1A1MAPTHPGDKDM4ENPSR1
SCHEMBL17990778 0.91 ALDH1A1 (0.43) ALDH1A1MAPTHPGDKDM4ENPSR1
SCHEMBL16919490 0.91 ALDH1A1 (0.47) ALDH1A1MAPTHPGDKDM4ENPSR1
SCHEMBL16919539 0.91 ALDH1A1 (0.39) ALDH1A1MAPTHPGDKDM4ENPSR1
SCHEMBL18620624 0.89 ALDH1A1 (0.38) ALDH1A1MAPTHPGDKDM4ENPSR1
SCHEMBL18619287 0.89 ALDH1A1 (0.38) ALDH1A1MAPTHPGDKDM4ENPSR1
SCHEMBL18619303 0.89 ALDH1A1 (0.38) ALDH1A1MAPTHPGDKDM4ENPSR1
SCHEMBL18619314 0.89 ALDH1A1 (0.38) ALDH1A1MAPTHPGDKDM4ENPSR1
SCHEMBL18620648 0.89 ALDH1A1 (0.38) ALDH1A1MAPTHPGDKDM4ENPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210119142-A1 ORGANIC ELECTROLUMINESCENT COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2021-04-22 US disclosed
US-20160225992-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-08-04 US disclosed
US-20160225992-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-08-04 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-20210119142-A1 ORGANIC ELECTROLUMINESCENT COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME ICOSLG, ELAVL1, OR10J3 ALDH1A1 924/4885MAPT 936/4885HPGD 3421/4885

“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.