SCHEMBL4048976

SCHEMBL4048976

O=C(NC1CC1)c1ccccc1O

nearest known ligand 0.83

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 6/20 0.83
LMNA P02545 5/20 0.83
KDM4E B2RXH2 4/20 0.83
RAB9A P51151 4/20 0.83
HTT P42858 4/20 0.83
HPGD P15428 3/20 0.83
ALDH1A1 P00352 2/20 0.83
SMN1; SMN2 Q16637 4/20 0.59
MAPK1 P28482 1/20 0.59
P2RX7 Q99572 1/20 0.57
GAA P10253 4/20 0.57
MPO P05164 1/20 0.57
HIF1A Q16665 1/20 0.57
MAPT P10636 2/20 0.55
TAS1R3 Q7RTX0 2/20 0.54
TAS1R1 Q7RTX1 2/20 0.54
TAS1R2 Q8TE23 2/20 0.54
MEN1 O00255 3/20 0.53
KMT2A Q03164 3/20 0.53
NPSR1 Q6W5P4 1/20 0.53

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
SCHEMBL14614940 0.91 ALDH1A1 (1.00) NPC1LMNAKDM4ERAB9AHTT
SCHEMBL31465178 0.88 NPC1 (0.71) NPC1LMNAKDM4ERAB9AHTT
SCHEMBL31465123 0.84 HTT (0.66) NPC1LMNAKDM4ERAB9AHTT
SCHEMBL12083372 0.81 KDM4E (0.73) NPC1LMNAKDM4ERAB9AHTT
SCHEMBL30013377 0.81 KDM4E (0.62) NPC1LMNAKDM4ERAB9AHTT
SCHEMBL13544567 0.81 GAA (0.58) NPC1LMNAKDM4ERAB9AHTT
SCHEMBL30666379 0.80 ALDH1A1 (0.77) NPC1LMNAKDM4ERAB9AHTT
SCHEMBL27785753 0.80 NPC1 (0.56) NPC1LMNAKDM4ERAB9AHTT
SCHEMBL13544831 0.79 NPC1 (0.58) NPC1LMNAKDM4ERAB9AHTT
SCHEMBL457993 0.79 NPC1 (0.84) NPC1LMNAKDM4ERAB9AHTT

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 46 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116616308-A Application of aromatic formamido-cyclopropane compound in promoting rice growth and development 郑州郑氏化工产品有限公司 2023-08-22 CN disclosed
US-20230135635-A1 INHIBITORS OF ULK1/2 AND METHODS OF USING SAME Sanford Burnham Prebys Medical Discovery Institute 2023-05-04 US disclosed
US-20230135635-A1 INHIBITORS OF ULK1/2 AND METHODS OF USING SAME Sanford Burnham Prebys Medical Discovery Institute 2023-05-04 US disclosed
US-20230135635-A1 INHIBITORS OF ULK1/2 AND METHODS OF USING SAME Sanford Burnham Prebys Medical Discovery Institute 2023-05-04 US disclosed
CN-115515589-A ULK1/2 inhibitors and methods of use thereof 萨克生物研究学院 2022-12-23 CN disclosed
EP-4103182-A1 INHIBITORS OF ULK1/2 AND METHODS OF USING SAME Salk Institute for Biological Studies (US) 2022-12-21 EP disclosed
EP-4070795-A1 NOVEL ULK1 INHIBITORS AND METHODS USING SAME Salk Institute for Biological Studies (US) 2022-10-12 EP disclosed
EP-3185868-B1 NOVEL ULK1 INHIBITORS AND METHODS USING SAME SALK INST FOR BIOLOGICAL STUDI (US) 2022-04-06 EP disclosed
WO-2021163629-A1 INHIBITORS OF ULK1/2 AND METHODS OF USING SAME SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) 2021-08-19 WO disclosed
US-10774092-B2 ULK1 inhibitors and methods using same SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) 2020-09-15 US disclosed
US-20050245741-A1 Novel tricyclic spiropiperidines or spiropyrrolidines ASTRAZENECA AB (SE) 2005-11-03 US disclosed
CN-1675218-A Novel tricyclic spiropiperidines or spiropyrrolidines ASTRAZENECA AB (SE) 2005-09-28 CN disclosed
EP-1521757-A1 NOVEL TRICYCLIC SPIROPIPERIDINES OR SPIROPYRROLIDINES AstraZeneca AB (SE) 2005-04-13 EP disclosed
US-20040209879-A1 Piperidinyl derivates as modulators of chemokine receptor activity ASTRAZENECA AB (SE) 2004-10-21 US disclosed
US-20040204408-A1 Piperidinyl-morpholinyl derivatives as modulators of chemokine receptor activity ASTRAZENECA AB (SE) 2004-10-14 US disclosed
EP-1421082-A1 NEW PIPERIDINYL-MORPHOLINYL DERIVATIVES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY AstraZeneca AB (SE) 2004-05-26 EP disclosed
EP-1421070-A1 NEW PIPERIDINYL DERIVATES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY AstraZeneca AB (SE) 2004-05-26 EP disclosed
WO-2004005295-A1 NOVEL TRICYCLIC SPIROPIPERIDINES OR SPIROPYRROLIDINES ASTRAZENECA AB (SE) 2004-01-15 WO disclosed
WO-2003018566-A1 NEW PIPERIDINYL DERIVATES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY ASTRAZENECA AB (SE) 2003-03-06 WO disclosed
WO-2003018576-A1 NEW PIPERIDINYL-MORPHOLINYL DERIVATIVES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY ASTRAZENECA AB (SE) 2003-03-06 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 (5 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-20040209879-A1 Piperidinyl derivates as modulators of chemokine receptor activity CCR2, CXCR1, CCR5 NPC1 1600/4885LMNA 3886/4885KDM4E 4172/4885
US-20230135635-A1 INHIBITORS OF ULK1/2 AND METHODS OF USING SAME ULK2, ULK1, ULK3 NPC1 1076/4885LMNA 2963/4885KDM4E 2417/4885
US-20050245741-A1 Novel tricyclic spiropiperidines or spiropyrrolidines REN, TACR1, AGTR1 NPC1 1196/4885LMNA 1862/4885KDM4E 2324/4885
US-20040204408-A1 Piperidinyl-morpholinyl derivatives as modulators of chemokine receptor activity CCR5, CCR2, CXCR2 NPC1 875/4885LMNA 3999/4885KDM4E 4616/4885
US-10774092-B2 ULK1 inhibitors and methods using same ULK1, ULK2, ULK3 NPC1 860/4885LMNA 4086/4885KDM4E 2384/4885

“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.