SCHEMBL7794937

SCHEMBL7794937

COc1cccc(C(=O)O)c1-c1ccccc1OC(C)C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FABP3 P05413 1/20 0.49
FABP4 P15090 1/20 0.49
FABP5 Q01469 1/20 0.49
IRAK4 Q9NWZ3 1/20 0.49
HTT P42858 1/20 0.49
ALDH1A1 P00352 5/20 0.46
MAPT P10636 2/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
LMNA P02545 1/20 0.46
HPGD P15428 3/20 0.45
KMT2A Q03164 3/20 0.45
KDM4E B2RXH2 2/20 0.45
HSD17B10 Q99714 1/20 0.45
GPR35 Q9HC97 1/20 0.45
CA1 P00915 2/20 0.44
CA2 P00918 2/20 0.44
CA7 P43166 2/20 0.44
CA9 Q16790 2/20 0.44
CA12 O43570 1/20 0.44
CA14 Q9ULX7 1/20 0.44

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
SCHEMBL7475795 0.88 HTT (0.57) FABP3FABP4FABP5HTTALDH1A1
SCHEMBL7796136 0.84 ALDH1A1 (0.49) FABP3FABP4FABP5IRAK4HTT
SCHEMBL7128802 0.83 KCNK3 (0.51) FABP3FABP4FABP5HTTALDH1A1
SCHEMBL7786417 0.83 POLB (0.48) HTTALDH1A1HPGDKMT2AKDM4E
SCHEMBL7795954 0.82 KEAP1 (0.59) IRAK4ALDH1A1MAPTLMNAHPGD
SCHEMBL27478705 0.82 IRAK4 (0.57) IRAK4HTTALDH1A1L3MBTL1LMNA
SCHEMBL14675659 0.81 HTT (0.53) FABP3FABP4FABP5HTTALDH1A1
SCHEMBL28370924 0.80 MYC (0.61) FABP3FABP4FABP5HTTALDH1A1
SCHEMBL15517040 0.78 GPR35 (0.57) FABP3FABP4FABP5HTTALDH1A1
SCHEMBL104892 0.78 IRAK4 (0.70) IRAK4HTTALDH1A1MAPTLMNA

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