SCHEMBL21889541

SCHEMBL21889541

Cc1ccc2c(c1)c1cc(C)ccc1n2-c1nc(-n2c3ccc(C)cc3c3cc(C)ccc32)c(-n2c3ccc(C)cc3c3cc(C)ccc32)c(-c2cc(-c3ccccc3)nc(-c3ccccc3)n2)c1-n1c2ccc(C)cc2c2cc(C)ccc21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.40
MEN1 O00255 7/20 0.40
KMT2A Q03164 7/20 0.40
KDM4E B2RXH2 6/20 0.40
MAPT P10636 6/20 0.40
HPGD P15428 5/20 0.40
TDP1 Q9NUW8 3/20 0.40
L3MBTL1 Q9Y468 3/20 0.40
NPSR1 Q6W5P4 3/20 0.40
HSD17B10 Q99714 1/20 0.40
LMNA P02545 1/20 0.40
RECQL P46063 1/20 0.40
NTSR1 P30989 1/20 0.38
ADORA3 P0DMS8 2/20 0.38
AGTR1 P30556 1/20 0.37
ADORA2A P29274 2/20 0.36
ADORA1 P30542 2/20 0.36
MAPK1 P28482 3/20 0.36
THRB P10828 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35

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
SCHEMBL30339378 1.00 ALDH1A1 (0.40) ALDH1A1MEN1KMT2AKDM4EMAPT
SCHEMBL30338806 0.96 MEN1 (0.38) ALDH1A1MEN1KMT2AKDM4EMAPT
SCHEMBL21888575 0.96 MEN1 (0.38) ALDH1A1MEN1KMT2AKDM4EMAPT
SCHEMBL30709239 0.93 ALDH1A1 (0.39) ALDH1A1MEN1KMT2AKDM4EMAPT
SCHEMBL29996967 0.92 MEN1 (0.43) ALDH1A1MEN1KMT2AKDM4EMAPT
SCHEMBL30709360 0.92 MAPT (0.39) ALDH1A1MEN1KMT2AKDM4EMAPT
SCHEMBL22148876 0.91 ALDH1A1 (0.39) ALDH1A1MEN1KMT2AKDM4EMAPT
SCHEMBL30709274 0.91 ALDH1A1 (0.39) ALDH1A1MEN1KMT2AKDM4EMAPT
SCHEMBL29995872 0.89 MEN1 (0.42) ALDH1A1MEN1KMT2AKDM4EMAPT
SCHEMBL21888620 0.89 NLRP3 (0.40) ALDH1A1MEN1KMT2AKDM4EMAPT

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-3642303-B1 COMPOSITION OF MATTER FOR USE IN ORGANIC LIGHT-EMITTING DIODES KYULUX INC (JP) 2021-04-14 EP disclosed
US-20200115376-A1 COMPOSITION OF MATTER FOR USE IN ORGANIC LIGHT-EMITTING DIODES KYULUX, INC. (JP) 2020-04-16 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-20200115376-A1 COMPOSITION OF MATTER FOR USE IN ORGANIC LIGHT-EMITTING DIODES CRY2, NDUFV3, SLCO1B3 ALDH1A1 241/4885MEN1 3155/4885KMT2A 4167/4885

“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.