SCHEMBL20364436

SCHEMBL20364436

COc1ccc2c(c1)c1cc(C)ccc1n2-c1c(C)cc(C(F)(F)F)cc1-c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GRIK2 Q13002 1/20 0.39
▸ PPARG P37231 2/20 0.39
▸ AKR1C3 P42330 5/20 0.39
▸ AKR1C2 P52895 3/20 0.39
▸ KDM4E B2RXH2 3/20 0.38
▸ HPGD P15428 3/20 0.38
▸ MAPT P10636 3/20 0.38
▸ HTT P42858 2/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37
▸ TP53 P04637 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ PLA2G2A P14555 1/20 0.36
▸ TSHR P16473 1/20 0.35
▸ GABRP O00591 1/20 0.35

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
SCHEMBL18361177 0.96 GRIK2 (0.42) GRIK2PPARGAKR1C3AKR1C2KDM4E
SCHEMBL18361181 0.91 METAP2 (0.39) KDM4EMAPTALDH1A1MEN1KMT2A
SCHEMBL20364439 0.89 GRIK2 (0.38) GRIK2PPARGAKR1C3AKR1C2KDM4E
SCHEMBL20364437 0.87 AKR1C3 (0.42) PPARGAKR1C3AKR1C2KDM4EHPGD
SCHEMBL18361173 0.85 PPARG (0.41) GRIK2PPARGAKR1C3AKR1C2KDM4E
SCHEMBL20364438 0.85 PPARG (0.43) GRIK2PPARGAKR1C3AKR1C2KDM4E
SCHEMBL20364440 0.83 AKR1C3 (0.36) PPARGAKR1C3AKR1C2KDM4EHPGD
SCHEMBL18361118 0.83 GRIK2 (0.39) GRIK2PPARGAKR1C3AKR1C2KDM4E
SCHEMBL20364446 0.82 GRIK2 (0.38) GRIK2KDM4EHPGDMAPTHTT
SCHEMBL18361165 0.80 METAP2 (0.39) PPARGMAPTALDH1A1L3MBTL1PTGDR2

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-20180198075-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2018-07-12 — — 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-20180198075-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES C1R, ORC3, OR10J3 GRIK2 2880/4885PPARG 4560/4885AKR1C3 110/4885

“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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