SCHEMBL7795758

SCHEMBL7795758

CC(Oc1cccc2c1C(=O)c1cccc(OC(C)C3CCCCN3)c1-2)C1CCCCN1

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 8/20 0.38
SLC6A2 P23975 6/20 0.38
SLC6A4 P31645 5/20 0.38
DHFR P00374 1/20 0.38
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
TSHR P16473 1/20 0.37
TDP1 Q9NUW8 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
SCHEMBL7786218 0.96 PDCD1LG2 (0.36) SLC6A3SLC6A2SLC6A4DHFRALDH1A1
SCHEMBL7794957 0.89 MEN1 (0.46) SLC6A3SLC6A2SLC6A4DHFRALDH1A1
SCHEMBL7794885 0.89 MEN1 (0.46) SLC6A3SLC6A2SLC6A4DHFRALDH1A1
SCHEMBL7786163 0.87 SLC6A3 (0.40) SLC6A3SLC6A2SLC6A4
SCHEMBL7794788 0.86 TTR (0.42) SLC6A3SLC6A2SLC6A4
SCHEMBL7786366 0.86 TTR (0.40) SLC6A3SLC6A2SLC6A4ALDH1A1
SCHEMBL7792225 0.85 MEN1 (0.47) ALDH1A1LMNATDP1
SCHEMBL7786168 0.85 MEN1 (0.47) ALDH1A1LMNATDP1
SCHEMBL7792655 0.84 HTR2A (0.40) SLC6A3SLC6A2SLC6A4
SCHEMBL7792041 0.84 SLC6A2 (0.47) SLC6A3SLC6A2SLC6A4ALDH1A1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0906268-B1 ALKYLOXYAMINO SUBSTITUTED FLUORENONES AND THEIR USE AS PROTEIN KINASE C INHIBITORS AVENTIS PHARMA INC (US) 2001-11-28 EP disclosed
US-6004959-A HYPOTENSIVE, ANTITUMOR, ANTIINFLAMMATORY AND ANTIASTHMATIC AGENTS; ANGIOGENESIS AND ALVEOLAR MACROPHAGE ACTIVATION INHIBITORS HOECHST MARION ROUSSEL, INC. (US) 1999-12-21 US disclosed
EP-0906268-A1 ALKYLOXYAMINO SUBSTITUTED FLUORENONES AND THEIR USE AS PROTEIN KINASE C INHIBITORS HOECHST MARION ROUSSEL, INC. (US) 1999-04-07 EP disclosed
WO-1997045397-A1 ALKYLOXYAMINO SUBSTITUTED FLUORENONES AND THEIR USE AS PROTEIN KINASE C INHIBITORS HOECHST MARION ROUSSEL, INC. (US) 1997-12-04 WO disclosed