SCHEMBL23487690

SCHEMBL23487690

N#Cc1cc(-n2c3ccccc3c3cc(-c4cc(C(F)(F)F)cc(C(F)(F)F)c4)ccc32)c(-c2nc(-c3ccccc3)cc(-c3ccccc3)n2)c(-n2c3ccccc3c3cc(-c4cc(C(F)(F)F)cc(C(F)(F)F)c4)ccc32)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 2/20 0.36
RXRA P19793 1/20 0.36
RXRG P48443 1/20 0.36
ABCB1 P08183 1/20 0.36
XDH P47989 1/20 0.35
MYC P01106 1/20 0.34
ICMT O60725 2/20 0.33
PTGER4 P35408 1/20 0.33
TACR1 P25103 1/20 0.33
CTSS P25774 1/20 0.33
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 2/20 0.32
TDP1 Q9NUW8 2/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
ALDH1A3 P47895 2/20 0.32
PDPK1 O15530 1/20 0.32
ACP1 P24666 1/20 0.32
GAA P10253 1/20 0.32
HPGD P15428 1/20 0.32
MAT2A P31153 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
SCHEMBL21108795 0.93 RXRA (0.37) ABCG2RXRARXRGABCB1ICMT
SCHEMBL19919552 0.93 RXRA (0.36) ABCG2RXRARXRGABCB1XDH
SCHEMBL23487278 0.90 ABCG2 (0.41) ABCG2ABCB1XDHCTSSKDM4E
SCHEMBL22563584 0.89 ABCG2 (0.38) ABCG2ABCB1MYCPTGER4KDM4E
SCHEMBL22563572 0.89 ABCG2 (0.40) ABCG2ABCB1MYCPTGER4KDM4E
SCHEMBL22563555 0.88 ABCG2 (0.41) ABCG2ABCB1MYCPTGER4KDM4E
SCHEMBL22563374 0.87 ABCG2 (0.41) ABCG2ABCB1XDHCTSSKDM4E
SCHEMBL19903668 0.87 RXRA (0.41) RXRARXRGICMTTACR1ALDH1A1
SCHEMBL19903528 0.87 RXRA (0.40) RXRARXRGXDHICMTPTGER4
SCHEMBL23545414 0.87 ABCG2 (0.36) ABCG2RXRARXRGABCB1XDH

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 1 patent. 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

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 2612/4885RXRA 2094/4885RXRG 1927/4885

“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.