SCHEMBL14946472

SCHEMBL14946472

CN(Cc1cccc(Cl)c1)C(=O)COC(C)(C)C

nearest known ligand 0.60

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ RIPK1 Q13546 1/20 0.60
▸ AOC3 Q16853 5/20 0.55
▸ MEN1 O00255 3/20 0.52
▸ KMT2A Q03164 3/20 0.52
▸ KDM4E B2RXH2 1/20 0.48
▸ ALDH1A1 P00352 1/20 0.48
▸ RAB9A P51151 3/20 0.46
▸ NPC1 O15118 2/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ ALOX5 P09917 1/20 0.44
▸ GAA P10253 1/20 0.44
▸ TACR1 P25103 1/20 0.44
▸ HPGD P15428 1/20 0.43
▸ HCAR2 Q8TDS4 1/20 0.43
▸ TSHR P16473 1/20 0.43
▸ RECQL P46063 1/20 0.43
▸ PYCR1 P32322 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
SCHEMBL14946490 0.84 RIPK1 (0.60) RIPK1AOC3MEN1KMT2AALDH1A1
SCHEMBL17278345 0.80 RIPK1 (0.61) RIPK1AOC3MEN1KMT2AALDH1A1
SCHEMBL29565507 0.80 RIPK1 (0.65) RIPK1AOC3MEN1KMT2AALDH1A1
SCHEMBL9824208 0.76 RIPK1 (0.64) RIPK1AOC3ALDH1A1NPC1SMN1; SMN2
SCHEMBL25711795 0.76 RIPK1 (0.59) RIPK1AOC3MEN1KMT2AALDH1A1
SCHEMBL14946457 0.75 HSD11B1 (0.51) AOC3MEN1KMT2ARAB9ANPC1
SCHEMBL17882179 0.75 RIPK1 (1.00) RIPK1AOC3GAA
SCHEMBL18773018 0.73 RIPK1 (0.53) RIPK1AOC3MEN1KMT2AKDM4E
SCHEMBL14540715 0.73 RIPK1 (0.59) RIPK1AOC3MEN1KMT2AALDH1A1
SCHEMBL14946473 0.72 ALDH1A1 (0.65) MEN1KMT2AKDM4EALDH1A1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 (3 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-20130123105-A1 Herbicidal Isoxazolo[5,4-B]pyridines CYP4X1, PNPO, PRDX4 RIPK1 4236/4885AOC3 892/4885MEN1 4689/4885
US-20160037777-A1 Herbicidal Isoxazolo[5,4-B]pyridines CYP4X1, PNPO, PRDX4 RIPK1 4236/4885AOC3 892/4885MEN1 4689/4885
US-20170367340-A1 Herbicidal Isoxazolo[5,4-B]pyridines CYP4X1, PNPO, PRDX4 RIPK1 4236/4885AOC3 892/4885MEN1 4689/4885

“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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