SCHEMBL22157606

SCHEMBL22157606

Fc1c(F)c(F)c(-c2c(-n3c4ccc(-c5ccccc5)cc4c4cc(-c5ccccc5)ccc43)cc(C(F)(F)F)cc2-n2c3ccc(-c4ccccc4)cc3c3cc(-c4ccccc4)ccc32)c(F)c1F

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KIF11 P52732 1/20 0.40
▸ TACR1 P25103 2/20 0.34
▸ ICMT O60725 2/20 0.34
▸ GLO1 Q04760 1/20 0.33
▸ TDP1 Q9NUW8 2/20 0.33
▸ ACLY P53396 2/20 0.32
▸ NR3C1 P04150 1/20 0.32
▸ PGR P06401 1/20 0.32
▸ KDM1A O60341 1/20 0.32
▸ SLC1A3 P43003 1/20 0.32
▸ SLC1A2 P43004 1/20 0.32
▸ SLC1A1 P43005 1/20 0.32
▸ S1PR5 Q9H228 1/20 0.32
▸ DHODH Q02127 1/20 0.32
▸ CCNE2 O96020 1/20 0.32
▸ CDK4 P11802 1/20 0.32
▸ CCND1 P24385 1/20 0.32
▸ CCNE1 P24864 1/20 0.32
▸ CDK2 P24941 1/20 0.32
▸ METAP2 P50579 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
SCHEMBL22157617 0.96 KIF11 (0.37) KIF11TACR1ICMTGLO1TDP1
SCHEMBL22157612 0.90 KIF11 (0.40) KIF11TACR1GLO1TDP1ACLY
SCHEMBL22156611 0.89 ABCG2 (0.34) KIF11TDP1NR3C1PGR
SCHEMBL22157616 0.89 KIF11 (0.38) KIF11TACR1GLO1TDP1METAP2
SCHEMBL22158632 0.88 KIF11 (0.39) KIF11TACR1ICMTGLO1TDP1
SCHEMBL22157280 0.88 TGFBR1 (0.37) TACR1TDP1CDK2
SCHEMBL22157284 0.88 CYP11B2 (0.38) TDP1NR3C1PGRKDM1ACDK2
SCHEMBL22156620 0.86 ABCG2 (0.35) KIF11TACR1TDP1
SCHEMBL22157447 0.86 KIF11 (0.39) KIF11TACR1ICMTGLO1TDP1
SCHEMBL22158642 0.85 TACR1 (0.36) KIF11TACR1ICMTTDP1NR3C1

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 4485/4885TACR1 936/4885ICMT 183/4885

“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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