SCHEMBL22157617

SCHEMBL22157617

Fc1c(F)c(F)c(-c2c(-n3c4ccccc4c4cc(-c5ccccc5)ccc43)cc(C(F)(F)F)cc2-n2c3ccccc3c3cc(-c4ccccc4)ccc32)c(F)c1F

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KIF11 P52732 2/20 0.37
▸ TACR1 P25103 7/20 0.37
▸ TSPO P30536 1/20 0.36
▸ ICMT O60725 1/20 0.33
▸ METAP2 P50579 1/20 0.32
▸ MGAM O43451 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ SI P14410 1/20 0.32
▸ MGAM2 Q2M2H8 1/20 0.32
▸ HSP90AA1 P07900 1/20 0.32
▸ GLO1 Q04760 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.31
▸ DNM1 Q05193 1/20 0.31
▸ TDP1 Q9NUW8 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
SCHEMBL22157606 0.96 KIF11 (0.40) KIF11TACR1ICMTMETAP2GLO1
SCHEMBL22157616 0.93 KIF11 (0.38) KIF11TACR1METAP2MGAMGAA
SCHEMBL22156620 0.90 ABCG2 (0.35) KIF11TACR1MGAMGAASI
SCHEMBL22158642 0.89 TACR1 (0.36) KIF11TACR1TSPOICMTTDP1
SCHEMBL22157612 0.89 KIF11 (0.40) KIF11TACR1METAP2MGAMGAA
SCHEMBL22156026 0.88 CYP11B1 (0.36) TACR1METAP2TDP1
SCHEMBL22157750 0.88 CYP11B2 (0.35) KIF11TACR1MGAMGAASI
SCHEMBL22157448 0.87 TACR1 (0.36) KIF11TACR1TSPOICMTMETAP2
SCHEMBL22157614 0.86 KIF11 (0.38) KIF11TACR1HSP90AA1ALDH1A1
SCHEMBL22157605 0.86 KIF11 (0.38) KIF11TACR1HSP90AA1ALDH1A1

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 936/4885TSPO 499/4885

“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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