SCHEMBL22157612

SCHEMBL22157612

Fc1c(F)c(F)c(-c2c(-n3c4cc(-c5ccccc5)ccc4c4ccc(-c5ccccc5)cc43)cc(C(F)(F)F)cc2-n2c3cc(-c4ccccc4)ccc3c3ccc(-c4ccccc4)cc32)c(F)c1F

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KIF11 P52732 2/20 0.40
▸ METAP2 P50579 1/20 0.34
▸ GLO1 Q04760 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ ACLY P53396 2/20 0.32
▸ TACR1 P25103 1/20 0.32
▸ LDHA P00338 1/20 0.32
▸ KDM1A O60341 1/20 0.32
▸ MAT2A P31153 1/20 0.32
▸ S1PR5 Q9H228 1/20 0.32
▸ DHODH Q02127 1/20 0.32
▸ PTPN1 P18031 1/20 0.31
▸ GAA P10253 2/20 0.31
▸ MGAM O43451 1/20 0.31
▸ SI P14410 1/20 0.31
▸ MGAM2 Q2M2H8 1/20 0.31
▸ HSP90AA1 P07900 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ MAOB P27338 1/20 0.31

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
SCHEMBL22157616 0.96 KIF11 (0.38) KIF11METAP2GLO1TDP1TACR1
SCHEMBL22157606 0.90 KIF11 (0.40) KIF11METAP2GLO1TDP1ACLY
SCHEMBL22156616 0.89 ABCG2 (0.34) KIF11METAP2TDP1MAT2AGAA
SCHEMBL22157617 0.89 KIF11 (0.37) KIF11METAP2GLO1TDP1TACR1
SCHEMBL22158628 0.88 KIF11 (0.39) KIF11METAP2GLO1KDM1AS1PR5
SCHEMBL22157287 0.88 TGFBR1 (0.39) METAP2TDP1
SCHEMBL22156025 0.88 CYP11B2 (0.38) METAP2TDP1KDM1AALDH1A1MAOB
SCHEMBL22156029 0.87 CYP11B2 (0.37) METAP2TDP1KDM1AMAT2AGAA
SCHEMBL22157481 0.86 KIF11 (0.39) KIF11METAP2GLO1TDP1ACLY
SCHEMBL22158641 0.85 KIF11 (0.37) KIF11METAP2TACR1KDM1AS1PR5

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 KIF11 4485/4885METAP2 3763/4885GLO1 2642/4885

“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.

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