SCHEMBL24671951

SCHEMBL24671951

CCNC(=O)C(O)(c1ccccc1)c1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 4/20 0.60
LMNA P02545 4/20 0.60
L3MBTL1 Q9Y468 1/20 0.60
CNR1 P21554 1/20 0.58
CNR2 P34972 1/20 0.58
ALDH1A1 P00352 4/20 0.54
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
SMN1; SMN2 Q16637 2/20 0.47
POLB P06746 2/20 0.47
GAA P10253 1/20 0.46
HPGD P15428 2/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
PAX8 Q06710 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
HDAC3 O15379 1/20 0.44
HDAC4 P56524 1/20 0.44
HDAC1 Q13547 1/20 0.44
HDAC7 Q8WUI4 1/20 0.44

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
SCHEMBL9475181 0.83 HTT (0.51) HTTLMNAL3MBTL1CNR1CNR2
SCHEMBL13255792 0.83 HDAC3 (0.47) HTTLMNAL3MBTL1CNR1CNR2
Hydrochloric Acid SCHEMBL9473641 0.82 HTT (0.50) HTTLMNAL3MBTL1CNR1CNR2
SCHEMBL20077095 0.81 MAPT (0.52) HTTLMNAL3MBTL1CNR1CNR2
SCHEMBL9472769 0.80 CNR1 (0.54) HTTLMNAL3MBTL1CNR1CNR2
SCHEMBL9473362 0.79 CNR1 (0.53) HTTLMNAL3MBTL1CNR1CNR2
SCHEMBL9476163 0.79 CNR1 (0.53) HTTLMNAL3MBTL1CNR1CNR2
SCHEMBL5068146 0.78 HDAC3 (0.42) HTTLMNAL3MBTL1CNR1CNR2
SCHEMBL4620848 0.78 HTT (0.56) HTTLMNAL3MBTL1CNR1CNR2
Hydrochloric Acid SCHEMBL9474191 0.78 CNR1 (0.51) HTTLMNAL3MBTL1CNR1CNR2

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
EP-3148518-B1 NOVEL COMPOUNDS AS ANTI-TUBERCULAR AGENTS SPHAERA PHARMA PRIVATE LTD (IN) 2022-11-30 EP disclosed