SCHEMBL23720374

SCHEMBL23720374

C=C(Nc1ccc(C(C)C)cc1C)c1cc(Cl)cc(Cl)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 4/20 0.39
▸ MAPK1 P28482 3/20 0.39
▸ SMN1; SMN2 Q16637 3/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ MAPT P10636 2/20 0.39
▸ ALOX12 P18054 2/20 0.39
▸ HPGD P15428 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ NOX1 Q9Y5S8 1/20 0.38
▸ TRPA1 O75762 1/20 0.37
▸ PTGS1 P23219 1/20 0.37
▸ CACNA1C Q13936 1/20 0.37
▸ POLB P06746 2/20 0.36
▸ CNR1 P21554 1/20 0.36
▸ CNR2 P34972 1/20 0.36
▸ MEN1 O00255 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ ALPL P05186 1/20 0.34

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
SCHEMBL18596028 0.77 ALDH1A1 (0.44) LMNAMAPK1SMN1; SMN2ALDH1A1MAPT
SCHEMBL18930369 0.75 TRPA1 (0.43) LMNAMAPK1SMN1; SMN2ALDH1A1MAPT
SCHEMBL18930354 0.73 TRPA1 (0.41) LMNAMAPK1SMN1; SMN2ALDH1A1MAPT
SCHEMBL9979294 0.71 MAPT (0.52) LMNAMAPTHPGDL3MBTL1TRPA1
SCHEMBL12190515 0.70 ALDH1A1 (0.52) LMNAMAPK1SMN1; SMN2ALDH1A1MAPT
SCHEMBL21023213 0.67 LMNA (0.48) LMNAMAPK1SMN1; SMN2ALDH1A1MAPT
SCHEMBL25497035 0.67 MAPK1 (0.50) LMNAMAPK1MAPTTRPA1PTGS1
SCHEMBL25494287 0.67 TP53 (0.44) LMNAMAPK1SMN1; SMN2ALDH1A1MAPT
SCHEMBL21565742 0.65 LMNA (0.42) LMNAMAPK1SMN1; SMN2ALDH1A1MAPT
SCHEMBL25494271 0.65 MEN1 (0.45) LMNAMAPK1SMN1; SMN2ALDH1A1MAPT

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-2021152623-A1 IMPROVED PROCESSES FOR THE PREPARATION OF TAFAMIDIS AND ITS MEGLUMINE SALT DR. REDDY’S LABORATORIES LIMITED (IN) 2021-08-05 — — WO disclosed
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