SCHEMBL22157677

SCHEMBL22157677

Cc1ccc2c3ccc(C)cc3n(-c3cc(C(F)(F)F)cc(-n4c5cc(C)ccc5c5ccc(C)cc54)c3-c3cc(F)cc(F)c3)c2c1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KIF11 P52732 3/20 0.34
▸ 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
▸ GABRB2 P47870 1/20 0.31
▸ GABRA4 P48169 1/20 0.31
▸ GABRE P78334 1/20 0.31
▸ GABRA6 Q16445 1/20 0.31
▸ GABRG1 Q8N1C3 1/20 0.31
▸ GABRG3 Q99928 1/20 0.31
▸ GABRQ Q9UN88 1/20 0.31
▸ PTGS1 P23219 1/20 0.31
▸ MAT2A P31153 1/20 0.31
▸ PTGDR2 Q9Y5Y4 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
SCHEMBL22157675 0.94 KIF11 (0.40) KIF11
SCHEMBL22157674 0.89 KIF11 (0.36) KIF11GABRPGABRDGABRA1GABRB1
SCHEMBL22157671 0.86 KIF11 (0.37) KIF11GABRPGABRDGABRA1GABRB1
SCHEMBL22157324 0.85 KIF11 (0.39) KIF11MAT2A
SCHEMBL22156729 0.83 KIF11 (0.35) KIF11PTGDR2
SCHEMBL19912480 0.83 KIF11 (0.33) KIF11PTGS1MAT2APTGDR2
SCHEMBL22156843 0.82 KIF11 (0.31) KIF11
SCHEMBL22157481 0.82 KIF11 (0.39) KIF11
SCHEMBL22158530 0.81 MAT2A (0.36) KIF11GABRPGABRDGABRA1GABRB1
SCHEMBL23299808 0.80 ALDH1A1 (0.35) —

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 4485/4885GABRP 1451/4885GABRD 3331/4885

“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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