SCHEMBL12371041

SCHEMBL12371041

CCOc1ccc(C2CCC(C3CC(=O)O3)CC2)cc1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.43
RAB9A P51151 1/20 0.42
NPC1 O15118 1/20 0.41
KDM4E B2RXH2 2/20 0.40
USP2 O75604 1/20 0.40
GAA P10253 1/20 0.40
HSD17B10 Q99714 1/20 0.40
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39
CRBN Q96SW2 1/20 0.39
NQO1 P15559 1/20 0.39
HTT P42858 1/20 0.39
MAPK1 P28482 1/20 0.38
MAPT P10636 1/20 0.37

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
SCHEMBL12371048 0.84 ALDH1A1 (0.44) ALDH1A1RAB9ANPC1USP2HSD17B10
SCHEMBL12371032 0.83 NOTUM (0.38) RAB9ANPC1
SCHEMBL12371053 0.82 RAB9A (0.41) ALDH1A1RAB9ANPC1MAOAMAOB
SCHEMBL12371065 0.81 SPHK1 (0.39) ALDH1A1CRBNMAPT
SCHEMBL9586183 0.80 NQO1 (0.61) RAB9AMAOAMAOBNQO1MAPT
SCHEMBL12371067 0.80 KDM4E (0.40) ALDH1A1RAB9AKDM4EGAAHSD17B10
SCHEMBL15086721 0.79 NPC1 (0.40) RAB9ANPC1CRBNMAPT
SCHEMBL12371000 0.79 MAP1LC3B (0.40) ALDH1A1MAOBMAPT
SCHEMBL12371013 0.79 FPR2 (0.34)
SCHEMBL2273765 0.78 MAP1LC3B (0.39) ALDH1A1MAOBMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2020407-B1 2-OXETANONE DERIVATIVE AND PROCESS FOR PRODUCTION THEREOF JNC CORP (JP) 2013-07-03 EP disclosed
US-7999123-B2 2-oxetanone derivative and process for production thereof JNC CORPORATION (JP) 2011-08-16 US disclosed
US-7999123-B2 2-oxetanone derivative and process for production thereof JNC CORPORATION (JP) 2011-08-16 US disclosed
US-20090275756-A1 2-OXETANONE DERIVATIVE AND PROCESS FOR PRODUCTION THEREOF CHISSO CORPORATION (JP) 2009-11-05 US disclosed
US-20090275756-A1 2-OXETANONE DERIVATIVE AND PROCESS FOR PRODUCTION THEREOF CHISSO CORPORATION (JP) 2009-11-05 US disclosed
EP-2020407-A1 2-OXETANONE DERIVATIVE AND PROCESS FOR PRODUCTION THEREOF Chisso Corporation (JP) 2009-02-04 EP 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-20090275756-A1 2-OXETANONE DERIVATIVE AND PROCESS FOR PRODUCTION THEREOF OGDH, OXGR1, OXER1 ALDH1A1 28/4885RAB9A 1699/4885NPC1 4534/4885

“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.