SCHEMBL5118907

SCHEMBL5118907

CN1CC(C)(C)Oc2cc(N)ccc21

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR3C2 P08235 1/20 0.37
MAPT P10636 7/20 0.37
KDM4E B2RXH2 5/20 0.37
GAA P10253 5/20 0.37
ALDH1A1 P00352 4/20 0.37
MEN1 O00255 4/20 0.37
KMT2A Q03164 4/20 0.37
SMN1; SMN2 Q16637 3/20 0.37
MITF O75030 1/20 0.37
MAPK1 P28482 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
NOTUM Q6P988 1/20 0.35
RAD52 P43351 1/20 0.35
F2 P00734 1/20 0.34
HTT P42858 1/20 0.34
THRB P10828 2/20 0.33
NR4A1 P22736 1/20 0.33
PTK2B Q14289 1/20 0.33
NISCH Q9Y2I1 1/20 0.33
LMNA P02545 1/20 0.33

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
SCHEMBL448820 0.88 MAPT (0.38) NR3C2MAPTKDM4EGAAALDH1A1
SCHEMBL23707743 0.78 NOTUM (0.34) NR3C2KDM4EGAAALDH1A1SMN1; SMN2
SCHEMBL17026884 0.78 NOTUM (0.34) NR3C2KDM4EGAAALDH1A1SMN1; SMN2
SCHEMBL17026861 0.76 TRPV1 (0.37) NR3C2KDM4EALDH1A1NOTUMLMNA
SCHEMBL755634 0.76 NR3C2 (0.63) NR3C2MAPTKDM4EGAAALDH1A1
SCHEMBL17175213 0.75 NISCH (0.52) MAPTKDM4EGAAALDH1A1MEN1
SCHEMBL9142188 0.74 NR3C2 (0.35) NR3C2MEN1KMT2AADRA2AADRA2B
SCHEMBL430404 0.72 ALDH1A1 (0.44) MAPTKDM4EGAAALDH1A1SMN1; SMN2
SCHEMBL28875503 0.72 MAPT (0.39) MAPTKDM4EGAAALDH1A1MEN1
SCHEMBL24359289 0.71 NR3C2 (0.40) NR3C2ALDH1A1F2NISCHL3MBTL1

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
WO-2022150574-A1 INHIBITORS OF MYCOBACTERIUM TUBERCULOSIS LIPOAMIDE DEHYDROGENASE CORNELL UNIVERSITY (US) 2022-07-14 WO disclosed
US-20080300241-A9 Tricyclic quinolinone and tricyclic quinoline androgen receptor modulator compounds and methods HIGUCHI ROBERT I 2008-12-04 US disclosed
US-7214690-B2 Tricyclic quinolinone and tricyclic quinoline androgen receptor modulator compounds and methods LIGAND PHARMACEUTICALS INCORPORATED (US) 2007-05-08 US disclosed
US-20070072849-A1 Tricyclic quinolinone and tricyclic quinoline androgen receptor modulator compounds and methods LIGAND PHARMACEUTICALS INCORPORATED 2007-03-29 US disclosed
EP-1368357-A1 TRICYCLIC QUINOLINONE AND TRICYCLIC QUINOLINE AS ANDROGEN RECEPTOR MODULATOR COMPOUNDS LIGAND PHARMACEUTICALS INCORPORATED (US) 2003-12-10 EP disclosed
US-20020183314-A1 Tricyclic quinolinone and tricyclic quinoline androgen receptor modulator compounds and methods LIGAND PHARMACEUTICALS INCORPORATED 2002-12-05 US disclosed
WO-2002068427-A1 TRICYCLIC QUINOLINONE AND TRICYCLIC QUINOLINE AS ANDROGEN RECEPTOR MODULATOR COMPOUNDS LIGAND PHARMACEUTICALS INCORPORATED (US) 2002-09-06 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 (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-20020183314-A1 Tricyclic quinolinone and tricyclic quinoline androgen receptor modulator compounds and methods AR, NR5A1, FSHR NR3C2 21/4885MAPT 2518/4885KDM4E 2013/4885
US-20080300241-A9 Tricyclic quinolinone and tricyclic quinoline androgen receptor modulator compounds and methods AR, NR5A1, FSHR NR3C2 16/4885MAPT 2588/4885KDM4E 2243/4885
US-20070072849-A1 Tricyclic quinolinone and tricyclic quinoline androgen receptor modulator compounds and methods AR, NR5A1, FSHR NR3C2 16/4885MAPT 2588/4885KDM4E 2243/4885

“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.