SCHEMBL8580333

SCHEMBL8580333

Oc1cccc(N(O)c2ccccc2)c1O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.44
HPGD P15428 5/20 0.44
HSD17B10 Q99714 5/20 0.44
ALOX15 P16050 4/20 0.44
LMNA P02545 3/20 0.44
TDP1 Q9NUW8 3/20 0.44
CA2 P00918 3/20 0.44
EGFR P00533 2/20 0.44
FYN P06241 2/20 0.44
MMP9 P14780 2/20 0.44
RECQL P46063 2/20 0.44
MMP2 P08253 2/20 0.44
CA1 P00915 2/20 0.44
ADAMTS4 O75173 1/20 0.44
MMP8 P22894 1/20 0.44
CA6 P23280 1/20 0.44
CDK2 P24941 1/20 0.44
MMP12 P39900 1/20 0.44
ADAMTS5 Q9UNA0 1/20 0.44
POLB P06746 5/20 0.37

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
SCHEMBL3809204 0.85 ALDH1A1 (0.41) ALDH1A1HPGDHSD17B10ALOX15LMNA
SCHEMBL8583501 0.83 POLB (0.44) ALDH1A1HPGDHSD17B10ALOX15LMNA
SCHEMBL5881115 0.81 ALDH1A1 (0.46) ALDH1A1HPGDHSD17B10ALOX15LMNA
SCHEMBL29912413 0.75 ALDH1A1 (0.55) ALDH1A1HPGDHSD17B10ALOX15LMNA
SCHEMBL1032263 0.71 NPSR1 (0.48) ALDH1A1HPGDALOX15LMNATDP1
SCHEMBL29553747 0.71 SIGMAR1 (0.53) ALDH1A1HSD17B10TDP1CYP3A4L3MBTL1
SCHEMBL15399896 0.71 SIGMAR1 (0.53) ALDH1A1HSD17B10TDP1CYP3A4L3MBTL1
SCHEMBL11513067 0.71 TSHR (0.42) ALDH1A1HPGDHSD17B10ALOX15LMNA
SCHEMBL16962795 0.70 CYP3A4 (0.39) ALDH1A1HPGDHSD17B10ALOX15TDP1
SCHEMBL23209756 0.69 ALDH1A1 (0.50) ALDH1A1HPGDHSD17B10ALOX15LMNA

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102559207-B Liquid crystal aligning agent, polymer, method for producing polymer, liquid crystal alignment film and liquid crystal display device JSR CORP 2015-01-14 CN disclosed
CN-102559207-A Liquid crystal aligning agent, polymer, method for producing polymer, liquid crystal alignment film and liquid crystal display device JSR CORP 2012-07-11 CN disclosed
US-5756650-A COMPOSITION COMPRISING POLYAMIC ACID, CURE ACCELERATOR SELECTED FROM GROUP CONSISTING OF NITROGEN-CONTAINING HETEROCYCLIC COMPOUND, AMINO ACID COMPOUND, AROMATIC COMPOUND HAVING TWO OR MORE HYDROXYL GROUPS KABUSHIKI KAISHA TOSHIBA (JP) 1998-05-26 US disclosed