SCHEMBL2269126

SCHEMBL2269126

COc1ccc(-n2c(C)ccc2C)nc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.51
KDM4E B2RXH2 6/20 0.51
L3MBTL1 Q9Y468 2/20 0.51
MAPT P10636 4/20 0.41
TSHR P16473 1/20 0.41
ALOX15 P16050 1/20 0.39
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
HPGD P15428 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
HSD17B10 Q99714 2/20 0.38
LMNA P02545 1/20 0.38
GAA P10253 1/20 0.38
HTT P42858 1/20 0.38
RECQL P46063 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
MAPK1 P28482 1/20 0.38
CA12 O43570 2/20 0.38
CA1 P00915 2/20 0.38
CA2 P00918 2/20 0.38

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
SCHEMBL30309516 1.00 ALDH1A1 (0.51) ALDH1A1KDM4EL3MBTL1MAPTTSHR
SCHEMBL13728582 0.80 RXFP1 (0.57) ALDH1A1MAPTALOX15MEN1KMT2A
SCHEMBL13728777 0.75 CYP3A4 (0.46) ALDH1A1KDM4EL3MBTL1MEN1KMT2A
SCHEMBL14022008 0.75 KDM4E (0.58) ALDH1A1KDM4EL3MBTL1MAPTMEN1
SCHEMBL22171208 0.75 CHRNB2 (0.49) ALDH1A1KDM4EL3MBTL1HRH3
SCHEMBL20912238 0.73 EGLN1 (0.39) ALDH1A1KDM4EMAPTMEN1KMT2A
SCHEMBL24921560 0.73 EGLN1 (0.37) ALDH1A1KDM4EMEN1KMT2ALMNA
SCHEMBL5363741 0.72 KDM4E (0.55) ALDH1A1KDM4EL3MBTL1MAPTMEN1
SCHEMBL2273392 0.72 KDM4E (0.55) ALDH1A1KDM4EL3MBTL1MAPTMEN1
SCHEMBL22171170 0.72 CHRNB2 (0.52) KDM4EHRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230192701-A1 BICYCLIC KINASE INHIBITORS AND USES THEREOF IOMX THERAPEUTICS AG (DE) 2023-06-22 US disclosed
US-20230192701-A1 BICYCLIC KINASE INHIBITORS AND USES THEREOF IOMX THERAPEUTICS AG (DE) 2023-06-22 US disclosed
EP-4143191-A2 BICYCLIC KINASE INHIBITORS AND USES THEREOF iOmx Therapeutics AG (DE) 2023-03-08 EP disclosed
WO-2021219731-A2 BICYCLIC KINASE INHIBITORS AND USES THEREOF IOMX THERAPEUTICS AG (DE) 2021-11-04 WO disclosed
WO-2021219731-A2 BICYCLIC KINASE INHIBITORS AND USES THEREOF IOMX THERAPEUTICS AG (DE) 2021-11-04 WO disclosed
US-7994187-B2 HIV inhibiting 3,4-dihydro-imidazo[4,5-B]pyridin-5-ones TIBOTEC PHARMACEUTICALS LTD. (IE) 2011-08-09 US disclosed
US-7994187-B2 HIV inhibiting 3,4-dihydro-imidazo[4,5-B]pyridin-5-ones TIBOTEC PHARMACEUTICALS LTD. (IE) 2011-08-09 US disclosed
US-7994187-B2 HIV inhibiting 3,4-dihydro-imidazo[4,5-B]pyridin-5-ones TIBOTEC PHARMACEUTICALS LTD. (IE) 2011-08-09 US disclosed
US-20090170855-A1 HIV INHIBITING 3,4-DIHYDRO-IMIDAZO[4,5-B]PYRIDIN-5-ONES TIBOTEC PHARMACEUTICALS LTD. (IE) 2009-07-02 US disclosed
US-20090170855-A1 HIV INHIBITING 3,4-DIHYDRO-IMIDAZO[4,5-B]PYRIDIN-5-ONES TIBOTEC PHARMACEUTICALS LTD. (IE) 2009-07-02 US disclosed
US-20090170855-A1 HIV INHIBITING 3,4-DIHYDRO-IMIDAZO[4,5-B]PYRIDIN-5-ONES TIBOTEC PHARMACEUTICALS LTD. (IE) 2009-07-02 US disclosed
EP-2004647-A1 HIV INHIBITING 3,4-DIHYDRO-IMIDAZOÝ4,5-B¨PYRIDIN-5-ONES Tibotec Pharmaceuticals Ltd. (IE) 2008-12-24 EP disclosed
WO-2007113290-A1 HIV INHIBITING 3,4-DIHYDRO-IMIDAZO[4,5-B]PYRIDIN-5-ONES TIBOTEC PHARMACEUTICALS LTD. (IE) 2007-10-11 WO disclosed
WO-2007113290-A1 HIV INHIBITING 3,4-DIHYDRO-IMIDAZO[4,5-B]PYRIDIN-5-ONES TIBOTEC PHARMACEUTICALS LTD. (IE) 2007-10-11 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 (2 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-20090170855-A1 HIV INHIBITING 3,4-DIHYDRO-IMIDAZO[4,5-B]PYRIDIN-5-ONES NR4A3, NR4A1, NR4A2 ALDH1A1 2020/4885KDM4E 3780/4885L3MBTL1 804/4885
US-20230192701-A1 BICYCLIC KINASE INHIBITORS AND USES THEREOF MITF, PRKDC, PRKACA ALDH1A1 3047/4885KDM4E 448/4885L3MBTL1 1116/4885

“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.