SCHEMBL22563510

SCHEMBL22563510

Cc1cc(C)nc(-c2cc(-n3c4ccccc4c4ccc(C(F)(F)F)cc43)c(C#N)c(-n3c4ccccc4c4ccc(C(F)(F)F)cc43)c2)n1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.43
MAT2A P31153 5/20 0.37
L3MBTL1 Q9Y468 1/20 0.35
ABCG2 Q9UNQ0 2/20 0.35
GRM5 P41594 4/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
POLB P06746 1/20 0.33
CTSS P25774 1/20 0.32
CTSK P43235 1/20 0.32
PIK3CD O00329 1/20 0.32
TP53 P04637 1/20 0.32
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL22563511 0.95 KIF11 (0.36) KIF11MAT2AL3MBTL1ABCG2GRM5
SCHEMBL19942762 0.92 KIF11 (0.43) KIF11MAT2AL3MBTL1GRM5POLB
SCHEMBL19909195 0.92 KIF11 (0.45) KIF11MAT2AL3MBTL1GRM5MEN1
SCHEMBL22563700 0.91 ALDH1A1 (0.34) KIF11L3MBTL1ABCG2MAPTKDM4E
SCHEMBL22563486 0.90 KIF11 (0.33) KIF11L3MBTL1ABCG2MEN1KMT2A
SCHEMBL19913303 0.88 KIF11 (0.42) KIF11MAT2AL3MBTL1GRM5MEN1
SCHEMBL21278871 0.87 KIF11 (0.41) KIF11MAT2AL3MBTL1GRM5MEN1
SCHEMBL23487618 0.86 KDM4E (0.34) L3MBTL1ABCG2KMT2APOLBGAA
SCHEMBL22563497 0.86 KDM4E (0.34) L3MBTL1ABCG2KMT2APOLBGAA
SCHEMBL22563684 0.86 PDE9A (0.35) L3MBTL1ABCG2TP53GAAMAPT

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 KIF11 3067/4885MAT2A 1269/4885L3MBTL1 3665/4885

“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.