SCHEMBL14946473

SCHEMBL14946473

CCOc1ccc(CN(C)C(=O)COC(C)(C)C)cc1

nearest known ligand 0.65

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.65
▸ SMN1; SMN2 Q16637 3/20 0.65
▸ KDM4E B2RXH2 2/20 0.65
▸ RAB9A P51151 5/20 0.56
▸ KMT2A Q03164 5/20 0.56
▸ MEN1 O00255 4/20 0.56
▸ NPC1 O15118 3/20 0.55
▸ MAPK1 P28482 1/20 0.53
▸ HTT P42858 1/20 0.48
▸ LMNA P02545 1/20 0.46
▸ MAPT P10636 1/20 0.44
▸ POLB P06746 1/20 0.44

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
SCHEMBL17278342 0.84 SMN1; SMN2 (0.70) ALDH1A1SMN1; SMN2KDM4ERAB9AKMT2A
SCHEMBL14946457 0.74 HSD11B1 (0.51) SMN1; SMN2RAB9AKMT2AMEN1NPC1
SCHEMBL14946472 0.72 RIPK1 (0.60) ALDH1A1SMN1; SMN2KDM4ERAB9AKMT2A
SCHEMBL14946490 0.72 RIPK1 (0.60) ALDH1A1SMN1; SMN2RAB9AKMT2AMEN1
SCHEMBL21566734 0.71 NQO1 (0.56) ALDH1A1SMN1; SMN2RAB9ANPC1MAPK1
SCHEMBL3963799 0.71 RAB9A (0.63) ALDH1A1SMN1; SMN2KDM4ERAB9AKMT2A
SCHEMBL13407919 0.70 HRH3 (0.63) ALDH1A1SMN1; SMN2KDM4EKMT2ALMNA
SCHEMBL8789904 0.70 MAPK1 (0.75) ALDH1A1SMN1; SMN2KDM4ERAB9AKMT2A
SCHEMBL8789438 0.70 SMN1; SMN2 (0.61) ALDH1A1SMN1; SMN2KDM4ERAB9AKMT2A
SCHEMBL13869754 0.69 RAB9A (0.76) ALDH1A1SMN1; SMN2KDM4ERAB9AKMT2A

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 10 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
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 ALDH1A1 292/4885SMN1; SMN2 4074/4885KDM4E 972/4885
US-20130123105-A1 Herbicidal Isoxazolo[5,4-B]pyridines CYP4X1, PNPO, PRDX4 ALDH1A1 292/4885SMN1; SMN2 4074/4885KDM4E 972/4885
US-20160037777-A1 Herbicidal Isoxazolo[5,4-B]pyridines CYP4X1, PNPO, PRDX4 ALDH1A1 292/4885SMN1; SMN2 4074/4885KDM4E 972/4885
US-20170367340-A1 Herbicidal Isoxazolo[5,4-B]pyridines CYP4X1, PNPO, PRDX4 ALDH1A1 292/4885SMN1; SMN2 4074/4885KDM4E 972/4885

“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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