SCHEMBL19874391

SCHEMBL19874391

COc1cc(-c2cc(F)cc(F)c2)c(F)cc1N

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.41
▸ CYP3A4 P08684 3/20 0.41
▸ TSHR P16473 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ GAA P10253 2/20 0.40
▸ ABCB1 P08183 1/20 0.39
▸ ABCC1 P33527 1/20 0.39
▸ FYN P06241 2/20 0.37
▸ PKM P14618 1/20 0.36
▸ MEN1 O00255 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ THRB P10828 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ S100B P04271 1/20 0.35
▸ MAOB P27338 1/20 0.33
▸ SCN9A Q15858 1/20 0.33
▸ ALOX5AP P20292 1/20 0.33

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
SCHEMBL19890354 0.83 FYN (0.48) ALDH1A1CYP3A4TSHRHSD17B10TDP1
SCHEMBL16290800 0.83 ERN1 (0.36) ABCB1ABCC1FYNSCN9A
SCHEMBL16306439 0.79 FYN (0.34) ABCB1ABCC1FYNSCN9A
SCHEMBL16290599 0.79 KIT (0.35) CYP3A4TSHRABCB1ABCC1FYN
SCHEMBL569225 0.76 L3MBTL1 (0.54) ALDH1A1CYP3A4TSHRHSD17B10TDP1
SCHEMBL30313255 0.76 L3MBTL1 (0.54) ALDH1A1CYP3A4TSHRHSD17B10TDP1
SCHEMBL19886441 0.76 CYP3A4 (0.39) ALDH1A1CYP3A4TSHRHSD17B10TDP1
SCHEMBL6371301 0.74 GAA (0.56) ALDH1A1CYP3A4TSHRHSD17B10TDP1
SCHEMBL16303551 0.73 FPR2 (0.36) ABCB1ABCC1FYNSCN9A
SCHEMBL16290729 0.73 SCN9A (0.39) SCN9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107531705-B Bicyclic ketone sulfonamide compounds 美国安进公司 2020-09-18 — — CN disclosed
US-10472356-B2 Bicyclic ketone sulfonamide compounds AMGEN INC. (US) 2019-11-12 — — US disclosed
US-10472356-B2 Bicyclic ketone sulfonamide compounds AMGEN INC. (US) 2019-11-12 — — US disclosed
EP-3265465-B1 BICYCLIC KETONE SULFONAMIDE COMPOUNDS AMGEN INC (US) 2019-04-24 — — EP disclosed
EP-3265465-B1 BICYCLIC KETONE SULFONAMIDE COMPOUNDS AMGEN INC (US) 2019-04-24 — — EP disclosed
US-20180051021-A1 BICYCLIC KETONE SULFONAMIDE COMPOUNDS AMGEN INC. (US) 2018-02-22 — — US disclosed
US-20180051021-A1 BICYCLIC KETONE SULFONAMIDE COMPOUNDS AMGEN INC. (US) 2018-02-22 — — 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 (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-10472356-B2 Bicyclic ketone sulfonamide compounds TRPV1, TRPA1, KCNJ11 ALDH1A1 601/4885CYP3A4 993/4885TSHR 3998/4885
US-20180051021-A1 BICYCLIC KETONE SULFONAMIDE COMPOUNDS TRPV1, TRPA1, KCNJ11 ALDH1A1 601/4885CYP3A4 993/4885TSHR 3998/4885

“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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