SCHEMBL1863145

SCHEMBL1863145

CCC(CC=CC(N)=O)CCCCC=CC(N)=O

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.46
▸ MAPT P10636 1/20 0.46
▸ FAAH O00519 3/20 0.36
▸ SOAT1 P35610 2/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ TP53 P04637 1/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ CNR1 P21554 1/20 0.34
▸ FFAR1 O14842 1/20 0.34
▸ FFAR4 Q5NUL3 1/20 0.34
▸ KDM4E B2RXH2 2/20 0.33
▸ PPARG P37231 2/20 0.32
▸ PPARA Q07869 2/20 0.32
▸ CA2 P00918 1/20 0.32
▸ TSHR P16473 1/20 0.31

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
SCHEMBL15572905 0.86 CA2 (0.44) ALDH1A1MEN1TP53CYP1A2CYP3A4
SCHEMBL1859961 0.85 PTPN1 (0.41) ALDH1A1MAPTFFAR1FFAR4PPARG
SCHEMBL21698085 0.82 CA2 (0.34) ALDH1A1MAPTCYP3A4CA2TSHR
SCHEMBL7626680 0.79 LMNA (0.48) ALDH1A1MAPTFAAHSOAT1MEN1
SCHEMBL21698109 0.76 CA2 (0.40) ALDH1A1MAPTFAAHSOAT1MEN1
SCHEMBL8386298 0.75 MAPT (0.47) ALDH1A1MAPTFAAHSOAT1MEN1
SCHEMBL8386296 0.75 MAPT (0.47) ALDH1A1MAPTFAAHSOAT1MEN1
SCHEMBL2090117 0.75 ALDH1A1 (0.60) ALDH1A1MAPTFAAHSOAT1MEN1
SCHEMBL28523571 0.75 FFAR1 (0.52) MAPTFAAHCYP1A2CYP2C19KMT2A
SCHEMBL3879333 0.74 FAAH (0.61) MAPTFAAHSOAT1MEN1TP53

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
US-20070206053-A1 Ink composition, inkjet recording method, process for producing lithographic printing plate, and lithographic printing plate FUJIFILM CORPORATION (JP) 2007-09-06 — — US claimed
US-7935742-B2 Ink composition, inkjet recording method, process for producing lithographic printing plate, and lithographic printing plate FUJIFILM CORPORATION (JP) 2011-05-03 — — US disclosed
US-20070206053-A1 Ink composition, inkjet recording method, process for producing lithographic printing plate, and lithographic printing plate FUJIFILM CORPORATION (JP) 2007-09-06 — — US disclosed
EP-1829941-A1 Ink composition, inkjet recording method, process for producing lithographic printing plate, and lithographic printing plate FUJIFILM Corporation (JP) 2007-09-05 — — EP disclosed
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