SCHEMBL18344154

SCHEMBL18344154

CCN(CC)c1nc2cc(N)ccc2o1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 11/20 0.49
NPC1 O15118 10/20 0.49
RXFP1 Q9HBX9 2/20 0.49
GFER P55789 2/20 0.49
IL6 P05231 1/20 0.48
STAT3 P40763 1/20 0.48
MEN1 O00255 5/20 0.48
KMT2A Q03164 5/20 0.48
CASP3 P42574 2/20 0.48
MAPT P10636 10/20 0.48
KDM4E B2RXH2 8/20 0.48
SMN1; SMN2 Q16637 8/20 0.48
ALDH1A1 P00352 8/20 0.48
HSD17B10 Q99714 7/20 0.48
TP53 P04637 5/20 0.48
NFKB1 P19838 2/20 0.48
NFKB2 Q00653 2/20 0.48
RELA Q04206 2/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
GRK6 P43250 1/20 0.48

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
SCHEMBL30028457 0.81 RAB9A (0.59) RAB9ANPC1RXFP1GFERMEN1
SCHEMBL21979448 0.78 HDAC6 (0.48) RAB9ANPC1MEN1KMT2AMAPT
SCHEMBL3746183 0.78 RAB9A (0.43) RAB9ANPC1RXFP1GFERIL6
SCHEMBL3750081 0.77 RAB9A (0.48) RAB9ANPC1RXFP1GFERIL6
SCHEMBL2245521 0.77 RAB9A (0.73) RAB9ANPC1RXFP1GFERMEN1
SCHEMBL8898712 0.76 ELANE (0.61) RAB9ANPC1MEN1KMT2AMAPT
SCHEMBL11856050 0.76 CYP1A2 (0.56) RAB9ANPC1MEN1KMT2AMAPT
SCHEMBL18344160 0.76 HDAC6 (0.49) RAB9ANPC1MEN1KMT2AMAPT
Hydrochloric Acid SCHEMBL3753685 0.76 RAB9A (0.47) RAB9ANPC1RXFP1GFERIL6
SCHEMBL13054198 0.75 RAB9A (0.46) RAB9ANPC1RXFP1GFERIL6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107743483-B NADPH oxidase 4 inhibitors 埃科特莱茵药品有限公司 2022-01-28 CN claimed
US-20210395238-A1 NADPH OXIDASE 4 INHIBITORS ACTELTION PHARMACEUTICALS LTD (CH) 2021-12-23 US claimed
EP-3310767-B1 2,5-DISUBSTITUTED BENZOXAZOLE AND BENZOTHIAZOLE COMPOUNDS AS NADPH OXIDASE 4 INHIBITORS ACTELION PHARMACEUTICALS LTD (CH) 2020-07-22 EP claimed
US-20200165235-A1 NADPH OXIDASE 4 INHIBITORS ACTELION PHARMACEUTICALS LTD (CH) 2020-05-28 US claimed
US-10584118-B2 NADPH oxidase 4 inhibitors ACTELION PHARMACEUTICALS LTD (CH) 2020-03-10 US claimed
US-20180179194-A1 NADPH OXIDASE 4 INHIBITORS ACTELION PHARMACEUTICALS LTD (CH) 2018-06-28 US claimed
EP-3310767-A1 NADPH OXIDASE 4 INHIBITORS Actelion Pharmaceuticals Ltd. (CH) 2018-04-25 EP claimed
WO-2016207785-A1 NADPH OXIDASE 4 INHIBITORS ACTELION PHARMACEUTICALS LTD (CH) 2016-12-29 WO claimed
CN-107743483-B NADPH oxidase 4 inhibitors 埃科特莱茵药品有限公司 2022-01-28 CN disclosed
US-20210395238-A1 NADPH OXIDASE 4 INHIBITORS ACTELTION PHARMACEUTICALS LTD (CH) 2021-12-23 US disclosed
US-11136317-B2 NADPH oxidase 4 inhibitors ACTELION PHARMACEUTICALS LTD (CH) 2021-10-05 US disclosed
EP-3310767-B1 2,5-DISUBSTITUTED BENZOXAZOLE AND BENZOTHIAZOLE COMPOUNDS AS NADPH OXIDASE 4 INHIBITORS ACTELION PHARMACEUTICALS LTD (CH) 2020-07-22 EP disclosed
US-20200165235-A1 NADPH OXIDASE 4 INHIBITORS ACTELION PHARMACEUTICALS LTD (CH) 2020-05-28 US disclosed
US-10584118-B2 NADPH oxidase 4 inhibitors ACTELION PHARMACEUTICALS LTD (CH) 2020-03-10 US disclosed
US-20180179194-A1 NADPH OXIDASE 4 INHIBITORS ACTELION PHARMACEUTICALS LTD (CH) 2018-06-28 US disclosed
EP-3310767-A1 NADPH OXIDASE 4 INHIBITORS Actelion Pharmaceuticals Ltd. (CH) 2018-04-25 EP disclosed
WO-2016207785-A1 NADPH OXIDASE 4 INHIBITORS ACTELION PHARMACEUTICALS LTD (CH) 2016-12-29 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-10584118-B2 NADPH oxidase 4 inhibitors NOX4, NOX1, CYBB RAB9A 2128/4885NPC1 3120/4885RXFP1 1494/4885
US-20200165235-A1 NADPH OXIDASE 4 INHIBITORS NOX4, NOX1, CYBB RAB9A 2128/4885NPC1 3120/4885RXFP1 1494/4885
US-11136317-B2 NADPH oxidase 4 inhibitors NOX4, NOX1, CYBB RAB9A 2128/4885NPC1 3120/4885RXFP1 1494/4885
US-20180179194-A1 NADPH OXIDASE 4 INHIBITORS NOX4, NOX1, CYBB RAB9A 2128/4885NPC1 3120/4885RXFP1 1494/4885
US-20210395238-A1 NADPH OXIDASE 4 INHIBITORS NOX4, NOX1, CYBB RAB9A 2128/4885NPC1 3120/4885RXFP1 1494/4885

“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.