SCHEMBL22157484

SCHEMBL22157484

Fc1cc(F)cc(-c2c(-n3c4ccccc4c4ccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)cc43)cc(C(F)(F)F)cc2-n2c3ccccc3c3ccc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)cc32)c1

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 8/20 0.36
TDP1 Q9NUW8 2/20 0.36
KIF11 P52732 1/20 0.34
MGAM O43451 1/20 0.33
GAA P10253 1/20 0.33
SI P14410 1/20 0.33
MGAM2 Q2M2H8 1/20 0.33
CTDSP1 Q9GZU7 1/20 0.33
NT5E P21589 2/20 0.32
TACR1 P25103 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
SCHEMBL22156740 0.97 TDP1 (0.38) ABCG2TDP1CTDSP1NT5E
SCHEMBL22156751 0.94 ABCG2 (0.36) ABCG2TDP1MGAMGAASI
SCHEMBL22156757 0.90 TDP1 (0.38) ABCG2TDP1CTDSP1NT5E
SCHEMBL22157478 0.90 KIF11 (0.37) TDP1KIF11MGAMGAASI
SCHEMBL22156669 0.88 KIF11 (0.34) ABCG2TDP1KIF11TACR1
SCHEMBL22156615 0.88 ABCG2 (0.35) ABCG2TDP1KIF11MGAMGAA
SCHEMBL22156674 0.88 TDP1 (0.35) ABCG2TDP1KIF11MGAMGAA
SCHEMBL22156766 0.87 ABCG2 (0.36) ABCG2KIF11MGAMGAASI
SCHEMBL22157481 0.86 KIF11 (0.39) TDP1KIF11CTDSP1NT5ETACR1
SCHEMBL22158705 0.86 ABCG2 (0.34) ABCG2NT5E

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-20200203628-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2020-06-25 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-20200203628-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES OR10J3, ORC3, OR51E2 ABCG2 1075/4885TDP1 4405/4885KIF11 4485/4885

“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.