SCHEMBL23922144

SCHEMBL23922144

CC(C)(C)CCOCCOCCn1cc(CC(C)(C)C)nn1

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NCF1 P14598 10/20 0.38
DRD2 P14416 6/20 0.38
CYBB P04839 1/20 0.37
NOX5 Q96PH1 1/20 0.37
DRD4 P21917 3/20 0.37
DRD3 P35462 3/20 0.37
GBA1 P04062 1/20 0.34
LGALS3 P17931 1/20 0.34

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
SCHEMBL24334134 1.00 NCF1 (0.38) NCF1DRD2CYBBNOX5DRD4
SCHEMBL26972310 0.98 NCF1 (0.38) NCF1DRD2CYBBNOX5DRD4
SCHEMBL18194474 0.92 NCF1 (0.40) NCF1DRD2CYBBNOX5DRD4
SCHEMBL25494738 0.88 DRD2 (0.42) NCF1DRD2CYBBNOX5DRD4
SCHEMBL24372151 0.88 NCF1 (0.43) NCF1CYBBNOX5
SCHEMBL25494745 0.88 DRD2 (0.42) NCF1DRD2CYBBNOX5DRD4
SCHEMBL25494740 0.88 DRD2 (0.42) NCF1DRD2CYBBNOX5DRD4
SCHEMBL24334135 0.88 DRD2 (0.39) NCF1DRD2CYBBNOX5DRD4
SCHEMBL19576264 0.87 NOTUM (0.39) NCF1DRD2CYBBNOX5DRD4
SCHEMBL26432992 0.87 GBA1 (0.45) NCF1DRD2CYBBNOX5DRD4

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
US-20230340000-A1 FUNCTIONALIZED N-ACETYLGALACTOSAMINE ANALOGS HONGENE BIOTECH CORPORATION 2023-10-26 US disclosed
US-20230340000-A1 FUNCTIONALIZED N-ACETYLGALACTOSAMINE ANALOGS HONGENE BIOTECH CORPORATION 2023-10-26 US disclosed
US-20230279041-A1 FUNCTIONALIZED N-ACETYLGALACTOSAMINE ANALOGS HONGENE BIOTECH CORPORATION 2023-09-07 US disclosed
US-11692001-B2 Functionalized n-acetylgalactosamine analogs HONGENE BIOTECH CORPORATION (US) 2023-07-04 US disclosed
US-11692001-B2 Functionalized n-acetylgalactosamine analogs HONGENE BIOTECH CORPORATION (US) 2023-07-04 US disclosed
US-11242337-B2 Compounds useful for treating gastrointestinal tract disorders ARDELYX, INC. (US) 2022-02-08 US disclosed
US-11147884-B2 Inhibitors of NHE-mediated antiport ARDELYX, INC. (US) 2021-10-19 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 (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-20230340000-A1 FUNCTIONALIZED N-ACETYLGALACTOSAMINE ANALOGS FUT6, CSGALNACT1, GALNT6 NCF1 1362/4885DRD2 4575/4885CYBB 1002/4885
US-11692001-B2 Functionalized n-acetylgalactosamine analogs FUT6, CSGALNACT1, GALNT6 NCF1 1362/4885DRD2 4575/4885CYBB 1002/4885
US-11242337-B2 Compounds useful for treating gastrointestinal tract disorders SLC10A2, FABP2, SLC10A1 NCF1 1426/4885DRD2 1423/4885CYBB 2776/4885
US-20230279041-A1 FUNCTIONALIZED N-ACETYLGALACTOSAMINE ANALOGS FUT6, CSGALNACT1, GALNT6 NCF1 1362/4885DRD2 4575/4885CYBB 1002/4885
US-11147884-B2 Inhibitors of NHE-mediated antiport SLC10A1, SLC10A2, SLC9A2 NCF1 716/4885DRD2 2090/4885CYBB 3155/4885

“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.