SCHEMBL5865674

SCHEMBL5865674

Oc1cc2c(c3cccnc13)CCN2

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 11/20 0.42
HSP90AA1 P07900 8/20 0.42
HTT P42858 6/20 0.42
L3MBTL1 Q9Y468 5/20 0.42
LMNA P02545 5/20 0.42
MAPT P10636 4/20 0.42
SLC6A2 P23975 3/20 0.42
IDO1 P14902 2/20 0.42
HSP90AB1 P08238 2/20 0.42
BRD4 O60885 2/20 0.42
METAP2 P50579 2/20 0.42
MPI P34949 1/20 0.42
METAP1 P53582 1/20 0.42
PSMB5 P28074 1/20 0.42
SMN1; SMN2 Q16637 5/20 0.41
NPC1 O15118 4/20 0.41
RAB9A P51151 4/20 0.41
GAA P10253 1/20 0.41
TDP1 Q9NUW8 5/20 0.40
MEN1 O00255 4/20 0.40

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
SCHEMBL5865707 0.81 NSD2 (0.42) HSP90AA1HTTL3MBTL1LMNAMAPT
SCHEMBL5357007 0.78 HTT (0.41) KDM4EHTTLMNAIDO1MPI
SCHEMBL5865477 0.70 MAPT (0.52) KDM4EHSP90AA1HTTL3MBTL1LMNA
SCHEMBL5369195 0.69 PRKD1 (0.42) KDM4EHSP90AA1HTTL3MBTL1LMNA
SCHEMBL5365445 0.69 DRD2 (0.37) DRD2
SCHEMBL13349977 0.68 PARP1 (0.40) HTTLMNADRD2
SCHEMBL170139 0.67 ALDH1A1 (0.59) KDM4EHSP90AA1HTTL3MBTL1LMNA
SCHEMBL1389187 0.67 KDM4E (0.52) KDM4EHSP90AA1HTTL3MBTL1LMNA
SCHEMBL18403202 0.67 PNMT (0.53) KDM4EHTTLMNAMAPTIDO1
SCHEMBL13154679 0.67 LMNA (0.52) KDM4EHSP90AA1HTTL3MBTL1LMNA

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
US-7064117-B2 Anti-cancer 2,3-dihydro-1H-pyrrolo[3,2-f]quinoline complexes of cobalt and chromium AUCKLAND UNISERVICES LIMITED (NZ) 2006-06-20 US disclosed
US-20050038249-A1 Anti-cancer 2,3-dihydro-1H-pyrrole[3,2-f] quinoline compolexes of cobalt and chromium AUCKLAND UNISERVICES LIMITED (NZ) 2005-02-17 US disclosed
US-20040138195-A1 Anti-cancer 2,3-dihydro-1h-pyrrolo[3,2-f[quinoline complexes of cobalt and chromium AUCKLAND UNISERVICES LIMITED (NZ) 2004-07-15 US disclosed
EP-1363908-A4 ANTI-CANCER 2,3-DIHYDRO-1H-PYRROLO 3,2-f]QUINOLINE COMPLEXES OF COBALT AND CHROMIUM AUCKLAND UNISERVICES LTD (NZ) 2004-05-06 EP disclosed
EP-1363908-A1 ANTI-CANCER 2,3-DIHYDRO-1H-PYRROLO 3,2-f]QUINOLINE COMPLEXES OF COBALT AND CHROMIUM Auckland Uniservices Limited (NZ) 2003-11-26 EP disclosed
WO-2002059122-A1 ANTI-CANCER 2,3-DIHYDRO-1H-PYRROLO[3,2-f]QUINOLINE COMPLEXES OF COBALT AND CHROMIUM AUCKLAND UNISERVICES LIMITED (NZ) 2002-08-01 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-20040138195-A1 Anti-cancer 2,3-dihydro-1h-pyrrolo[3,2-f[quinoline complexes of cobalt and chromium IDH1, HIF1AN, CA2 KDM4E 784/4885HSP90AA1 3362/4885HTT 4474/4885
US-20050038249-A1 Anti-cancer 2,3-dihydro-1H-pyrrole[3,2-f] quinoline compolexes of cobalt and chromium CA2, HIF1AN, PPOX KDM4E 331/4885HSP90AA1 3153/4885HTT 4474/4885

“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.