SCHEMBL22157671

SCHEMBL22157671

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

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KIF11 P52732 2/20 0.37
▸ TACR1 P25103 5/20 0.36
▸ BCHE P06276 1/20 0.33
▸ ACHE P22303 1/20 0.33
▸ HRH1 P35367 1/20 0.33
▸ HTR6 P50406 1/20 0.33
▸ MAPT P10636 2/20 0.33
▸ LMNA P02545 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ HSP90AA1 P07900 1/20 0.31
▸ TP53 P04637 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
▸ GABRB3 P28472 1/20 0.31
▸ GABRA5 P31644 1/20 0.31
▸ GABRA3 P34903 1/20 0.31
▸ GABRA2 P47869 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
SCHEMBL22157674 0.94 KIF11 (0.36) KIF11TACR1HRH1HTR6MAPT
SCHEMBL22157675 0.93 KIF11 (0.40) KIF11TACR1BCHEACHEMAPT
SCHEMBL22157352 0.88 KIF11 (0.40) KIF11TACR1HRH1HTR6HSP90AA1
SCHEMBL22156735 0.87 KIF11 (0.35) KIF11TACR1HSP90AA1TDP1
SCHEMBL22156737 0.87 KIF11 (0.35) KIF11TACR1HSP90AA1TDP1
SCHEMBL22157677 0.86 KIF11 (0.34) KIF11GABRPGABRDGABRA1GABRB1
SCHEMBL22157448 0.86 TACR1 (0.36) KIF11TACR1TDP1
SCHEMBL22156728 0.85 KIF11 (0.39) KIF11TACR1BCHEACHEHRH1
SCHEMBL22157676 0.85 KIF11 (0.45) KIF11TACR1HSP90AA1TDP1
SCHEMBL22156035 0.84 BCHE (0.35) KIF11BCHEACHEMAPTLMNA

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 4485/4885TACR1 936/4885BCHE 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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