SCHEMBL7795759

SCHEMBL7795759

O=C1c2cccc(OCCC3CCCCN3)c2-c2cccc(OCCC3CCCCN3)c21

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KCNA3 P22001 1/20 0.43
PIM1 P11309 1/20 0.43
PIM2 Q9P1W9 1/20 0.43
KMT2A Q03164 1/20 0.41
SSTR2 P30874 3/20 0.39
IDO1 P14902 1/20 0.38
CHRNB4 P30926 1/20 0.38
CHRNA3 P32297 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
SCHEMBL7786221 0.96 KCNA3 (0.44) KCNA3PIM1PIM2KMT2AIDO1
SCHEMBL7792615 0.90 KCNA3 (0.46) KCNA3PIM1PIM2KMT2ACHRNB4
SCHEMBL7792650 0.89 PIM1 (0.42) KCNA3PIM1PIM2KMT2ASSTR2
SCHEMBL8382321 0.89 KCNA3 (0.41) KCNA3PIM1PIM2KMT2ACHRNB4
SCHEMBL7792707 0.89 PIM1 (0.40) KCNA3PIM1PIM2KMT2ASSTR2
SCHEMBL7794783 0.88 PIM1 (0.41) KCNA3PIM1PIM2KMT2ASSTR2
SCHEMBL7794951 0.88 CHRNB4 (0.47) KCNA3PIM1PIM2KMT2ASSTR2
SCHEMBL7794880 0.88 CHRNB4 (0.44) PIM1PIM2KMT2ASSTR2CHRNB4
SCHEMBL7786360 0.88 PIM1 (0.40) KCNA3PIM1PIM2KMT2ASSTR2
SCHEMBL7791873 0.87 ELANE (0.43) KCNA3PIM1PIM2KMT2ASSTR2

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