SCHEMBL29240564

SCHEMBL29240564

O=C(O)c1n[nH]c(O)c1[InH2]

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ HCAR2 Q8TDS4 19/20 0.41
▸ KMT2A Q03164 1/20 0.38
▸ TSHR P16473 1/20 0.37
▸ SLC6A4 P31645 1/20 0.34
▸ DAO P14920 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
SCHEMBL7234538 0.73 HCAR2 (0.57) HCAR2KMT2ATSHRDAO
SCHEMBL7254688 0.65 KDM4C (0.48) HCAR2KMT2ATSHRSLC6A4
SCHEMBL27455057 0.65 LMNA (0.47) HCAR2
SCHEMBL12050672 0.62 — —
SCHEMBL30581110 0.61 HCAR2 (0.39) HCAR2KMT2ATSHRDAO
SCHEMBL11029352 0.61 KDM4E (0.54) HCAR2KMT2ATSHR
SCHEMBL4631308 0.60 HCAR2 (0.63) HCAR2DAO
SCHEMBL28973274 0.60 HCAR2 (0.63) HCAR2KMT2ATSHRSLC6A4
SCHEMBL3152179 0.60 HCAR2 (0.42) HCAR2KMT2ATSHRSLC6A4
SCHEMBL2763438 0.60 HCAR2 (0.63) HCAR2KMT2ATSHRSLC6A4

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-113876600-B Detection and treatment of caries and microcavities with nanoparticles 密歇根大学董事会 2024-05-17 — — CN disclosed
Send feedback