SCHEMBL27413627

SCHEMBL27413627

NNC(=O)N(N)c1cc(O)ccc1O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.44
GFER P55789 2/20 0.44
MAPT P10636 5/20 0.43
BLM P54132 3/20 0.43
HIF1A Q16665 3/20 0.43
CYP1A2 P05177 3/20 0.43
CYP2C9 P11712 3/20 0.43
HPGD P15428 3/20 0.43
ALOX15 P16050 3/20 0.43
CYP2C19 P33261 3/20 0.43
HSD17B10 Q99714 3/20 0.43
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
TDP1 Q9NUW8 3/20 0.43
PMP22 Q01453 2/20 0.43
LMNA P02545 2/20 0.43
POLB P06746 2/20 0.43
APEX1 P27695 2/20 0.43
RECQL P46063 2/20 0.43
RGS12 O14924 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
Hydrochloric Acid SCHEMBL28153342 0.98 ALDH1A1 (0.43) ALDH1A1GFERMAPTBLMHIF1A
SCHEMBL27666419 0.86 ALDH1A1 (0.49) ALDH1A1GFERMAPTBLMHIF1A
SCHEMBL27902642 0.83 ALDH1A1 (0.39) ALDH1A1GFERMAPTBLMHIF1A
SCHEMBL27902643 0.77 AOC3 (0.43) ALDH1A1GFERMAPTHPGDMEN1
SCHEMBL28180042 0.73 CYP3A4 (0.47) ALDH1A1GFERMAPTBLMHIF1A
SCHEMBL27601452 0.71 ALDH1A1 (0.49) ALDH1A1GFERMAPTBLMCYP1A2
SCHEMBL23712739 0.69 BAZ2B (0.36) ALDH1A1GFERMAPTBLMHIF1A
SCHEMBL9390028 0.67
SCHEMBL927389 0.67 ALDH1A1 (0.55) ALDH1A1GFERMAPTBLMHIF1A
SCHEMBL9139876 0.66 ALDH1A1 (0.71) ALDH1A1GFERMAPTBLMHIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1091786-A High speed spinning process for polybenzazole fibers DOW CHEMICAL CO (US) 1994-09-07 CN disclosed