SCHEMBL7795729

SCHEMBL7795729

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

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ELANE P08246 2/20 0.50
HTR1B P28222 2/20 0.48
HTR1D P28221 1/20 0.48
KCNA3 P22001 1/20 0.48
ALDH1A1 P00352 1/20 0.47
MAPT P10636 1/20 0.46
CHRNA7 P36544 1/20 0.46
KMT2A Q03164 1/20 0.46
FLT3 P36888 2/20 0.43
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
SCHEMBL7786145 0.94 MAPT (0.52) ELANEHTR1BHTR1DKCNA3ALDH1A1
SCHEMBL7792085 0.94 KCNA3 (0.48) ELANEHTR1BHTR1DKCNA3ALDH1A1
SCHEMBL7796356 0.93 HTR1B (0.45) ELANEHTR1BHTR1DKCNA3ALDH1A1
SCHEMBL7796352 0.92 KCNA3 (0.48) HTR1BHTR1DKCNA3ALDH1A1MAPT
SCHEMBL7786093 0.91 MAPT (0.50) ELANEHTR1BHTR1DKCNA3MAPT
SCHEMBL7795691 0.90 ALDH1A1 (0.56) ELANEKCNA3ALDH1A1MAPTKMT2A
SCHEMBL7795878 0.88 KCNA3 (0.45) HTR1BHTR1DKCNA3ALDH1A1FLT3
SCHEMBL7796426 0.88 HTR1B (0.48) ELANEHTR1BHTR1DKCNA3ALDH1A1
SCHEMBL7796272 0.88 MAPT (0.60) ELANEKCNA3ALDH1A1MAPTCHRNA7
Hydrochloric Acid SCHEMBL11606378 0.88 KCNA3 (0.60) HTR1BHTR1DKCNA3ALDH1A1MAPT

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