SCHEMBL22563374

SCHEMBL22563374

N#Cc1cc(-n2c3ccc(C(F)(F)F)cc3c3cc(C(F)(F)F)ccc32)c(-c2nc(-c3ccccc3)cc(-c3ccccc3)n2)c(-n2c3ccc(C(F)(F)F)cc3c3cc(C(F)(F)F)ccc32)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 4/20 0.41
ABCB1 P08183 3/20 0.41
MAT2A P31153 1/20 0.37
CTSS P25774 2/20 0.37
KDM4E B2RXH2 4/20 0.36
ALDH1A1 P00352 3/20 0.36
L3MBTL1 Q9Y468 3/20 0.36
TDP1 Q9NUW8 2/20 0.36
HPGD P15428 2/20 0.36
GAA P10253 1/20 0.36
KIF11 P52732 1/20 0.36
DGAT1 O75907 1/20 0.35
SOAT1 P35610 1/20 0.35
KCNH2 Q12809 1/20 0.35
LMNA P02545 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
XDH P47989 1/20 0.35
CTSK P43235 2/20 0.34
GRM5 P41594 1/20 0.34
TOP1 P11387 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
SCHEMBL23487278 0.97 ABCG2 (0.41) ABCG2ABCB1MAT2ACTSSKDM4E
SCHEMBL21279075 0.94 ABCG2 (0.41) ABCG2ABCB1MAT2ACTSSKDM4E
SCHEMBL21108009 0.92 ABCG2 (0.40) ABCG2ABCB1MAT2ACTSSKIF11
SCHEMBL19909381 0.91 ABCG2 (0.38) ABCG2ABCB1MAT2ACTSSKDM4E
SCHEMBL23487714 0.90 ABCG2 (0.41) ABCG2ABCB1CTSSKDM4EKIF11
SCHEMBL22563580 0.90 ALOX5AP (0.36) ABCG2ABCB1MAT2AKDM4EALDH1A1
SCHEMBL21108016 0.89 ABCG2 (0.38) ABCG2ABCB1MAT2AKIF11
SCHEMBL19913275 0.89 ABCG2 (0.39) ABCG2ABCB1MAT2ACTSSKDM4E
SCHEMBL23487713 0.87 ABCG2 (0.42) ABCG2ABCB1CTSSKDM4EKIF11
SCHEMBL22268417 0.87 ABCG2 (0.39) ABCG2ABCB1MAT2ACTSSKDM4E

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 ABCG2 2612/4885ABCB1 1179/4885MAT2A 1269/4885

“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.