SCHEMBL31471640

SCHEMBL31471640

CCCCCCN1C=CC(C(=O)O)=CC1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 3/20 0.38
PTGS2 P35354 3/20 0.38
MGLL Q99685 3/20 0.38
FAAH O00519 1/20 0.38
KCNH2 Q12809 1/20 0.35
GRM2 Q14416 1/20 0.35
PLA2G2A P14555 1/20 0.33
TP53 P04637 1/20 0.33
TSHR P16473 1/20 0.33
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL31471622 1.00 PTGS1 (0.38) PTGS1PTGS2MGLLFAAHKCNH2
SCHEMBL29067694 1.00 PTGS1 (0.38) PTGS1PTGS2MGLLFAAHKCNH2
SCHEMBL31471635 0.94 GRM2 (0.38) GRM2
SCHEMBL27889971 0.87 PTGS1 (0.37) PTGS1PTGS2MGLLFAAHKCNH2
Bromide SCHEMBL27743415 0.85 PTGS1 (0.36) PTGS1PTGS2MGLLFAAHKCNH2
SCHEMBL2993004 0.85 PTGS1 (0.34) PTGS1PTGS2MGLLFAAHGRM2
SCHEMBL31282201 0.80
SCHEMBL31471592 0.80
SCHEMBL27770860 0.80 GSK3A (0.46) MGLLFAAHMAPT
SCHEMBL2997584 0.80 GRM2 (0.35) GRM2

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-119707792-A Triphenylamine-pyridinium salt fluorescent probe for rapid detection of urinary albumin and preparation method thereof 海南大学 2025-03-28 CN disclosed