SCHEMBL9710399

SCHEMBL9710399

NC1CC(O)CC(N)N1.O=S(=O)(O)Oc1ccccn1

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FURIN P09958 1/20 0.36
KDM4E B2RXH2 1/20 0.36
MAPT P10636 1/20 0.36
HPGD P15428 1/20 0.36
NAAA Q02083 1/20 0.33
KDM1A O60341 1/20 0.32
EPHX2 P34913 1/20 0.32
TSHR P16473 1/20 0.30
SLC22A6 Q4U2R8 1/20 0.30

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
SCHEMBL3857735 0.81 LMNA (0.41) KDM4EHPGDTSHRSLC22A6
SCHEMBL1407987 0.68 LMNA (0.35) FURINKDM4ETSHR
SCHEMBL28588858 0.68 LMNA (0.38) FURINKDM4ETSHR
SCHEMBL6512183 0.67 KDM4E (0.44) KDM4EHPGDTSHR
SCHEMBL23611463 0.66 KDM4E (0.39) KDM4EHPGDNAAA
SCHEMBL1360826 0.64 LMNA (0.41) KDM4ENAAATSHR
SCHEMBL1407984 0.64 KDM4E (0.41) KDM4EHPGDTSHR
SCHEMBL6220452 0.64 TDP1 (0.43) KDM4EHPGD
SCHEMBL11554272 0.62 PTGS2 (0.40) KDM4ENAAATSHR
Sulfuric Acid SCHEMBL18260153 0.62 POLB (0.42) KDM4EMAPTTSHR

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
WO-1992021317-A1 PYRIDINE 1-OXIDE BASED COMPOSITION FOR COMBATTING HAIR LOSS AND FOR INDUCING AND STIMULATING HAIR GROWTH L'OREAL (FR) 1992-12-10 WO claimed