SCHEMBL22563450

SCHEMBL22563450

N#Cc1cc(-n2c3ccccc3c3cc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)ccc32)c(-c2nc(-c3ccccc3)cc(-c3ccccc3)n2)cc1-n1c2ccccc2c2cc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)ccc21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.40
KMT2A Q03164 6/20 0.40
ALDH1A1 P00352 4/20 0.40
HPGD P15428 4/20 0.40
MAPT P10636 3/20 0.40
NTSR1 P30989 1/20 0.37
LMNA P02545 3/20 0.36
KDM4E B2RXH2 3/20 0.36
GLA P06280 1/20 0.36
SQOR Q9Y6N5 3/20 0.35
CYP1A2 P05177 2/20 0.35
CYP2C9 P11712 2/20 0.35
CYP2C19 P33261 2/20 0.35
NPSR1 Q6W5P4 2/20 0.35
ABCG2 Q9UNQ0 1/20 0.35
CSNK2A1 P68400 1/20 0.34
ADORA1 P30542 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
ADORA2A P29274 1/20 0.34
MAPK1 P28482 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
SCHEMBL22563552 0.98 MEN1 (0.42) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL21278885 0.96 MEN1 (0.40) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL19942771 0.96 CYP1A2 (0.38) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL23487346 0.94 MEN1 (0.40) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL21278787 0.93 MEN1 (0.42) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL22563710 0.93 SQOR (0.36) MEN1KMT2AHPGDKDM4ESQOR
SCHEMBL19942790 0.93 CYP1A2 (0.37) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL19908971 0.93 MEN1 (0.36) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL19943181 0.92 NPSR1 (0.37) MEN1KMT2AALDH1A1LMNAKDM4E
SCHEMBL22563471 0.92 NPSR1 (0.37) MEN1KMT2AALDH1A1HPGDNTSR1

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
US-20210175434-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2021-06-10 US disclosed
EP-3580300-B1 ORGANIC MOLECULES, ESPECIALLY FOR USE IN ORGANIC OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2020-10-21 EP 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-20210175434-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES OR10J3, OR51E2, OCIAD2 MEN1 2472/4885KMT2A 3474/4885ALDH1A1 80/4885

“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.