SCHEMBL7796426

SCHEMBL7796426

CCCCOc1ccc(OCCN(CC)CC)c2c1-c1c(OCCN(CC)CC)cccc1C2=O

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTR1B P28222 2/20 0.48
HTR1D P28221 1/20 0.48
MAPT P10636 1/20 0.46
CHRNA7 P36544 1/20 0.46
KMT2A Q03164 1/20 0.46
KCNA3 P22001 1/20 0.45
MAOB P27338 1/20 0.45
ELANE P08246 1/20 0.44
BIRC5 O15392 1/20 0.43
ALDH1A1 P00352 2/20 0.42
KDM4E B2RXH2 1/20 0.42
LMNA P02545 1/20 0.42
DRD2 P14416 1/20 0.42
DRD1 P21728 1/20 0.42
DRD3 P35462 1/20 0.42
TERT O14746 1/20 0.41

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
SCHEMBL7796356 0.95 HTR1B (0.45) HTR1BHTR1DKCNA3MAOBELANE
SCHEMBL7791858 0.94 MAOB (0.46) HTR1BHTR1DMAPTCHRNA7KMT2A
SCHEMBL7786145 0.93 MAPT (0.52) HTR1BHTR1DMAPTCHRNA7KMT2A
SCHEMBL7792355 0.91 MAOB (0.46) HTR1BHTR1DMAPTCHRNA7KMT2A
SCHEMBL7795878 0.90 KCNA3 (0.45) HTR1BHTR1DKCNA3MAOBALDH1A1
SCHEMBL7792089 0.90 ALDH1A1 (0.49) MAPTCHRNA7KMT2AKCNA3MAOB
SCHEMBL7795729 0.88 ELANE (0.50) HTR1BHTR1DMAPTCHRNA7KMT2A
SCHEMBL7794808 0.87 CYP1A2 (0.43) HTR1BHTR1DMAPTCHRNA7KMT2A
SCHEMBL7794690 0.87 KCNA3 (0.45) HTR1BHTR1DMAPTKMT2AKCNA3
SCHEMBL7792639 0.87 MAPT (0.50) HTR1BHTR1DMAPTCHRNA7KMT2A

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