SCHEMBL10828352

SCHEMBL10828352

CC(C)Oc1ccc2c(c1)CC(=O)N2

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
AHR P35869 2/20 0.51
MAOB P27338 3/20 0.51
EIF2AK2 P19525 1/20 0.50
GRIA1 P42261 3/20 0.47
CACNG8 Q8WXS5 2/20 0.47
PDE3B Q13370 2/20 0.46
PDE3A Q14432 2/20 0.46
GAA P10253 3/20 0.45
PDK2 Q15119 1/20 0.44
EPHX2 P34913 1/20 0.44
SMYD3 Q9H7B4 3/20 0.43
PGR P06401 1/20 0.43
SRC P12931 1/20 0.43

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
SCHEMBL14521048 0.87 EIF2AK2 (0.68) AHRMAOBEIF2AK2PDE3BPDE3A
SCHEMBL25899778 0.84 MAOB (0.55) AHRMAOBEIF2AK2GRIA1CACNG8
SCHEMBL6980695 0.83 GAA (0.48) AHRMAOBEIF2AK2GRIA1CACNG8
SCHEMBL28346887 0.83 GAA (0.52) AHRMAOBEIF2AK2GRIA1CACNG8
SCHEMBL20214 0.81 PDE3B (0.66) AHRMAOBEIF2AK2GRIA1CACNG8
SCHEMBL31040124 0.81 PDE3B (0.66) AHRMAOBEIF2AK2GRIA1CACNG8
SCHEMBL14124533 0.81 TLK2 (0.38) MAOBGRIA1PDE3BPDE3ASRC
SCHEMBL6981292 0.81 AHR (0.51) AHRMAOBEIF2AK2GRIA1CACNG8
SCHEMBL31414247 0.79 MEN1 (0.40) AHRMAOBPDE3BPDE3AGAA
SCHEMBL27691373 0.79 MAOB (0.50) AHRMAOBEIF2AK2GRIA1CACNG8

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-20140205537-A1 LRRK2 INHIBITORS ZENOBIA THERAPEUTICS, INC. (US) 2014-07-24 US disclosed
US-20140205537-A1 LRRK2 INHIBITORS ZENOBIA THERAPEUTICS, INC. (US) 2014-07-24 US disclosed
US-20140205537-A1 LRRK2 INHIBITORS ZENOBIA THERAPEUTICS, INC. (US) 2014-07-24 US disclosed
WO-2012178015-A2 LRRK2 INHIBITORS ZENOBIA THERAPEUTICS, INC. (US) 2012-12-27 WO disclosed
WO-2012178015-A2 LRRK2 INHIBITORS ZENOBIA THERAPEUTICS, INC. (US) 2012-12-27 WO disclosed
US-4622336-A ANALGESICS SANDOZ LTD. (CH) 1986-11-11 US disclosed
WO-1983002610-A1 DERIVATIVES OF 3,3-DIALKYL-INDOLIN AND OF 3,3-ALKYLENE-INDOLIN, METHOD FOR PRODUCING THEM AND PHARMACEUTICAL PREPARATIONS CONTAINING THEM SANDOZ AG (CH) 1983-08-04 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 (1 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-20140205537-A1 LRRK2 INHIBITORS LRRK2, PARK7, MAP2 AHR 4284/4885MAOB 1759/4885EIF2AK2 354/4885

“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.