SCHEMBL22157688

SCHEMBL22157688

Cc1ccc2c(c1)c1ccccc1n2-c1cc(C(F)(F)F)cc(-n2c3ccccc3c3cc(C)ccc32)c1-c1c(F)cccc1F

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KIF11 P52732 2/20 0.38
▸ RXFP1 Q9HBX9 1/20 0.34
▸ BCHE P06276 1/20 0.34
▸ ACHE P22303 1/20 0.34
▸ TP53 P04637 2/20 0.33
▸ MAT2A P31153 1/20 0.33
▸ GLA P06280 1/20 0.33
▸ PTGDR2 Q9Y5Y4 2/20 0.33
▸ TACR1 P25103 2/20 0.32
▸ MAPT P10636 2/20 0.32
▸ PPARG P37231 1/20 0.32
▸ PPARA Q07869 1/20 0.32
▸ HSP90AA1 P07900 1/20 0.32
▸ HRH1 P35367 1/20 0.31
▸ HTR6 P50406 1/20 0.31
▸ GABRP O00591 1/20 0.31
▸ GABRD O14764 1/20 0.31
▸ GABRA1 P14867 1/20 0.31
▸ GABRB1 P18505 1/20 0.31
▸ GABRG2 P18507 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
SCHEMBL22158535 0.95 KIF11 (0.36) KIF11BCHEACHETP53MAT2A
SCHEMBL22157691 0.93 KIF11 (0.41) KIF11RXFP1MAT2AGLATACR1
SCHEMBL22156728 0.89 KIF11 (0.39) KIF11BCHEACHETP53PTGDR2
SCHEMBL22158534 0.88 KIF11 (0.41) KIF11MAT2APPARGPPARAHSP90AA1
SCHEMBL22158530 0.87 MAT2A (0.36) KIF11TP53MAT2AGLAPTGDR2
SCHEMBL22158633 0.86 KIF11 (0.36) KIF11MAT2APPARGPPARAHSP90AA1
SCHEMBL22156750 0.86 KIF11 (0.36) KIF11MAT2APPARGPPARAHSP90AA1
SCHEMBL22158531 0.84 KIF11 (0.46) KIF11MAT2AGLAPPARGPPARA
SCHEMBL22158642 0.84 TACR1 (0.36) KIF11TACR1
SCHEMBL22157671 0.84 KIF11 (0.37) KIF11BCHEACHETP53PTGDR2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3635070-B1 ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2021-04-28 — — EP disclosed
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 4485/4885RXFP1 678/4885BCHE 3315/4885

“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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