SCHEMBL14946457

SCHEMBL14946457

CN(Cc1ccsc1)C(=O)COC(C)(C)C

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ HSD11B1 P28845 2/20 0.51
▸ RAB9A P51151 6/20 0.48
▸ NPC1 O15118 4/20 0.48
▸ KMT2A Q03164 2/20 0.48
▸ TRPM8 Q7Z2W7 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ HCAR3 P49019 2/20 0.39
▸ HCAR2 Q8TDS4 1/20 0.39
▸ MAPK1 P28482 2/20 0.38
▸ GAA P10253 1/20 0.38
▸ CYP1A2 P05177 1/20 0.36
▸ CYP2C9 P11712 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ AOC3 Q16853 1/20 0.36
▸ PDK1 Q15118 3/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL14948977 0.84 HSD11B1 (0.54) HSD11B1RAB9ANPC1KMT2ATRPM8
SCHEMBL18716599 0.80 HSD11B1 (0.51) HSD11B1RAB9ANPC1KMT2ATRPM8
SCHEMBL12313813 0.79 HSD11B1 (0.58) HSD11B1RAB9ANPC1KMT2ATRPM8
SCHEMBL12265806 0.77 HSD11B1 (0.52) HSD11B1RAB9ANPC1KMT2ATRPM8
SCHEMBL14946490 0.75 RIPK1 (0.60) RAB9ANPC1KMT2ASMN1; SMN2MEN1
SCHEMBL14946472 0.75 RIPK1 (0.60) RAB9ANPC1KMT2ASMN1; SMN2MEN1
SCHEMBL21400129 0.75 HSD11B1 (0.56) HSD11B1RAB9ANPC1KMT2ATRPM8
SCHEMBL14946473 0.74 ALDH1A1 (0.65) RAB9ANPC1KMT2ASMN1; SMN2MEN1
SCHEMBL6667849 0.70 HSD11B1 (0.51) HSD11B1RAB9ANPC1KMT2ATRPM8
SCHEMBL14505914 0.69 TAAR1 (0.42) RAB9ANPC1KMT2AMEN1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10334851-B2 Herbicidal isoxazolo[5,4-B]pyridines BASF SE (DE) 2019-07-02 — — US disclosed
US-20170367340-A1 Herbicidal Isoxazolo[5,4-B]pyridines BASF SE (DE) 2017-12-28 — — US disclosed
US-9609870-B2 Herbicidal isoxazolo[5,4-b]pyridines BASF SE (DE) 2017-04-04 — — US disclosed
US-9609870-B2 Herbicidal isoxazolo[5,4-b]pyridines BASF SE (DE) 2017-04-04 — — US disclosed
US-20160037777-A1 Herbicidal Isoxazolo[5,4-B]pyridines BASF SE (DE) 2016-02-11 — — US disclosed
US-20160037777-A1 Herbicidal Isoxazolo[5,4-B]pyridines BASF SE (DE) 2016-02-11 — — US disclosed
US-9131695-B2 Herbicidal isoxazolo[5,4-B]pyridines BASF SE (DE) 2015-09-15 — — US disclosed
US-9131695-B2 Herbicidal isoxazolo[5,4-B]pyridines BASF SE (DE) 2015-09-15 — — US disclosed
US-20130123105-A1 Herbicidal Isoxazolo[5,4-B]pyridines BASF SE (DE) 2013-05-16 — — 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 (4 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-10334851-B2 Herbicidal isoxazolo[5,4-B]pyridines CYP4X1, PNPO, PRDX4 HSD11B1 1012/4885RAB9A 2712/4885NPC1 4803/4885
US-20130123105-A1 Herbicidal Isoxazolo[5,4-B]pyridines CYP4X1, PNPO, PRDX4 HSD11B1 1012/4885RAB9A 2712/4885NPC1 4803/4885
US-20160037777-A1 Herbicidal Isoxazolo[5,4-B]pyridines CYP4X1, PNPO, PRDX4 HSD11B1 1012/4885RAB9A 2712/4885NPC1 4803/4885
US-20170367340-A1 Herbicidal Isoxazolo[5,4-B]pyridines CYP4X1, PNPO, PRDX4 HSD11B1 1012/4885RAB9A 2712/4885NPC1 4803/4885

“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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