SCHEMBL7794783

SCHEMBL7794783

CCOc1cccc2c1-c1c(OCCC3CCCCN3)cccc1C2=O

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 1/20 0.41
PIM2 Q9P1W9 1/20 0.41
TTR P02766 1/20 0.41
DDB1 Q16531 1/20 0.40
CRBN Q96SW2 1/20 0.40
KMT2A Q03164 1/20 0.40
SSTR2 P30874 2/20 0.40
CHRNB4 P30926 1/20 0.39
CHRNA3 P32297 1/20 0.39
PTPRC P08575 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
KCNA3 P22001 1/20 0.39
CHRNB2 P17787 1/20 0.38
CHRNA4 P43681 1/20 0.38

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
SCHEMBL7795907 0.96 CHRNB4 (0.42) PIM1PIM2TTRDDB1CRBN
SCHEMBL7786360 0.94 PIM1 (0.40) PIM1PIM2TTRDDB1CRBN
SCHEMBL7792650 0.94 PIM1 (0.42) PIM1PIM2KMT2ASSTR2CHRNB4
SCHEMBL7791873 0.92 ELANE (0.43) PIM1PIM2KMT2ASSTR2CHRNB4
SCHEMBL7794727 0.92 TTR (0.39) PIM1PIM2TTRDDB1CRBN
SCHEMBL7795922 0.92 TTR (0.39) PIM1PIM2TTRDDB1CRBN
SCHEMBL7786143 0.91 CHRNB4 (0.40) PIM1PIM2TTRDDB1CRBN
SCHEMBL7794951 0.91 CHRNB4 (0.47) PIM1PIM2KMT2ASSTR2CHRNB4
SCHEMBL7792203 0.91 CHRNB4 (0.43) PIM1PIM2SSTR2CHRNB4CHRNA3
SCHEMBL7795875 0.90 CYP1A2 (0.40) PIM1PIM2TTRDDB1CRBN

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 2 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