SCHEMBL16127490

SCHEMBL16127490

Fc1cncc(F)c1-c1cccc(C(F)(F)F)c1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ IDO1 P14902 1/20 0.53
▸ SCN2A Q99250 2/20 0.51
▸ IKBKB O14920 1/20 0.51
▸ HRH1 P35367 1/20 0.50
▸ HRH4 Q9H3N8 1/20 0.50
▸ EPHX2 P34913 1/20 0.49
▸ TDP1 Q9NUW8 1/20 0.48
▸ NPY5R Q15761 1/20 0.48
▸ BRD4 O60885 1/20 0.48
▸ MAPT P10636 1/20 0.47
▸ NOTUM Q6P988 2/20 0.45
▸ NR3C1 P04150 1/20 0.45
▸ PGR P06401 1/20 0.45
▸ DYRK1A Q13627 1/20 0.44
▸ DYRK2 Q92630 1/20 0.44
▸ MAOB P27338 1/20 0.44
▸ NPC1 O15118 1/20 0.43
▸ RAB9A P51151 1/20 0.43

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
SCHEMBL16127491 0.85 IKBKB (0.53) IDO1SCN2AIKBKBHRH1HRH4
SCHEMBL29656838 0.78 IKBKB (0.46) IDO1SCN2AIKBKBHRH1HRH4
SCHEMBL17563223 0.77 SLC1A3 (0.50) IDO1SCN2AIKBKBTDP1BRD4
SCHEMBL1263144 0.76 TSHR (0.58) IDO1SCN2ANOTUMPGRMAOB
SCHEMBL29678302 0.76 TSHR (0.58) IDO1SCN2ANOTUMPGRMAOB
SCHEMBL27684281 0.74 IDO1 (0.51) IDO1SCN2AHRH1HRH4EPHX2
SCHEMBL17563217 0.74 RPS6KA3 (0.48) IDO1NPY5RNR3C1NPC1RAB9A
Ammonia Solution, Strong SCHEMBL20472961 0.74 MAOB (0.56) IDO1SCN2ANOTUMPGRMAOB
SCHEMBL3560166 0.74 IKBKB (0.43) IDO1SCN2AIKBKBHRH1HRH4
SCHEMBL10940225 0.73 NPY5R (0.64) IDO1EPHX2NPY5RNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3375785-B1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2020-08-05 — — EP disclosed
US-10193079-B2 Materials for electronic devices MERCK PATENT GMBH (DE) 2019-01-29 — — US disclosed
EP-2976329-B1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2018-06-27 — — EP disclosed
US-20160072076-A1 MATERIALS FOR ELECTRONIC DEVICES UDC IRELAND LIMITED (IE) 2016-03-10 — — US disclosed
WO-2014146752-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2014-09-25 — — WO 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 (2 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-20160072076-A1 MATERIALS FOR ELECTRONIC DEVICES AOC3, AOC2, AOC1 IDO1 1370/4885SCN2A 2601/4885IKBKB 4638/4885
US-10193079-B2 Materials for electronic devices AOC3, AOC2, AOC1 IDO1 1370/4885SCN2A 2601/4885IKBKB 4638/4885

“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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