SCHEMBL7791975

SCHEMBL7791975

CCOc1cc(OCC)c2c(c1)C(=O)c1cccc(OCCN3CCCC3)c1-2

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
KDM4E B2RXH2 4/20 0.48
HTT P42858 1/20 0.48
TSHR P16473 1/20 0.46
TDP1 Q9NUW8 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.44
POLB P06746 1/20 0.44
ELANE P08246 1/20 0.43
ACHE P22303 1/20 0.43

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
SCHEMBL7794725 0.99 KDM4E (0.48) ALDH1A1L3MBTL1KDM4EHTTTSHR
SCHEMBL7791841 0.98 ALDH1A1 (0.49) ALDH1A1L3MBTL1KDM4EHTTTSHR
SCHEMBL7795919 0.97 KDM4E (0.48) ALDH1A1L3MBTL1KDM4EHTTTSHR
SCHEMBL7792673 0.96 KDM4E (0.46) ALDH1A1L3MBTL1KDM4EHTTTSHR
SCHEMBL7786319 0.95 POLB (0.50) ALDH1A1L3MBTL1KDM4EHTTTSHR
SCHEMBL7786160 0.95 ALDH1A1 (0.46) ALDH1A1L3MBTL1KDM4EHTTTSHR
SCHEMBL7794869 0.95 KDM4E (0.46) ALDH1A1L3MBTL1KDM4EHTTTSHR
SCHEMBL7786170 0.94 ALDH1A1 (0.54) ALDH1A1L3MBTL1KDM4EHTTTSHR
SCHEMBL7792338 0.94 POLB (0.49) ALDH1A1KDM4EHTTTSHRPOLB
SCHEMBL7792138 0.94 ALDH1A1 (0.46) ALDH1A1L3MBTL1KDM4EHTTTSHR

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