SCHEMBL7786145

SCHEMBL7786145

CCCCOc1cccc2c1-c1c(OCCN(CC)CC)cccc1C2=O

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.52
CHRNA7 P36544 1/20 0.52
KMT2A Q03164 1/20 0.52
HTR1B P28222 2/20 0.51
HTR1D P28221 1/20 0.51
ELANE P08246 2/20 0.50
KCNA3 P22001 1/20 0.48
MAOB P27338 1/20 0.47
ALDH1A1 P00352 2/20 0.45
KDM4E B2RXH2 1/20 0.45
LMNA P02545 1/20 0.45
DRD2 P14416 1/20 0.45
DRD1 P21728 1/20 0.45
DRD3 P35462 1/20 0.45
TERT O14746 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
SCHEMBL7795729 0.94 ELANE (0.50) MAPTCHRNA7KMT2AHTR1BHTR1D
SCHEMBL7796426 0.93 HTR1B (0.48) MAPTCHRNA7KMT2AHTR1BHTR1D
SCHEMBL7792639 0.93 MAPT (0.50) MAPTCHRNA7KMT2AHTR1BHTR1D
SCHEMBL7786494 0.91 MAPT (0.56) MAPTCHRNA7KMT2AHTR1BHTR1D
SCHEMBL7796277 0.90 MAPT (0.50) MAPTCHRNA7KMT2AHTR1BHTR1D
SCHEMBL7786472 0.89 KMT2A (0.52) MAPTCHRNA7KMT2AELANEKCNA3
SCHEMBL7792085 0.89 KCNA3 (0.48) MAPTCHRNA7KMT2AHTR1BHTR1D
SCHEMBL7792434 0.89 MAPT (0.51) MAPTCHRNA7KMT2AHTR1BHTR1D
SCHEMBL7792157 0.89 MAPT (0.54) MAPTCHRNA7KMT2AHTR1BHTR1D
SCHEMBL7791978 0.89 MAPT (0.51) MAPTCHRNA7KMT2AHTR1BHTR1D

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