SCHEMBL7792650

SCHEMBL7792650

CCCOc1cccc2c1-c1c(OCCC3CCCCN3)cccc1C2=O

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 1/20 0.42
PIM2 Q9P1W9 1/20 0.42
HTR2A P28223 1/20 0.41
HTR2C P28335 1/20 0.41
HTR2B P41595 1/20 0.41
KMT2A Q03164 1/20 0.41
SSTR2 P30874 2/20 0.40
CHRNB4 P30926 1/20 0.40
CHRNA3 P32297 1/20 0.40
KCNA3 P22001 1/20 0.40
CHRNB2 P17787 1/20 0.38
CHRNA4 P43681 1/20 0.38
HSP90AA1 P07900 1/20 0.38
HSP90AB1 P08238 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
SCHEMBL7792203 0.96 CHRNB4 (0.43) PIM1PIM2HTR2AHTR2CHTR2B
SCHEMBL7791873 0.95 ELANE (0.43) PIM1PIM2HTR2AHTR2CHTR2B
SCHEMBL7792707 0.94 PIM1 (0.40) PIM1PIM2HTR2AHTR2CHTR2B
SCHEMBL7794783 0.94 PIM1 (0.41) PIM1PIM2KMT2ASSTR2CHRNB4
SCHEMBL7794951 0.92 CHRNB4 (0.47) PIM1PIM2KMT2ASSTR2CHRNB4
SCHEMBL7795723 0.92 ELANE (0.44) PIM1PIM2HTR2AHTR2CHTR2B
SCHEMBL7795843 0.92 KCNA3 (0.39) PIM1PIM2HTR2AHTR2CHTR2B
SCHEMBL7786122 0.92 KCNA3 (0.39) PIM1PIM2HTR2AHTR2CHTR2B
SCHEMBL8382782 0.91 ELANE (0.43) PIM1PIM2HTR2AHTR2CHTR2B
SCHEMBL7792624 0.91 CHRNB4 (0.41) PIM1PIM2HTR2AHTR2CHTR2B

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