SCHEMBL10905168

SCHEMBL10905168

Cc1cc(C(=O)Nc2cc(S(=O)(=O)O)cc3cc(O)ccc23)ccc1NC(=O)C(=O)Nc1ccc(C(=O)Nc2cc(S(=O)(=O)O)cc3cc(O)ccc23)cc1C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.46
▸ MAPT P10636 3/20 0.46
▸ KMT2A Q03164 3/20 0.46
▸ TDP1 Q9NUW8 3/20 0.46
▸ RAB9A P51151 2/20 0.46
▸ LMNA P02545 1/20 0.46
▸ CASP6 P55212 2/20 0.43
▸ CTDSP1 Q9GZU7 1/20 0.43
▸ APEX1 P27695 1/20 0.43
▸ TAS1R3 Q7RTX0 1/20 0.41
▸ TAS1R1 Q7RTX1 1/20 0.41
▸ TAS1R2 Q8TE23 1/20 0.41
▸ HPSE Q9Y251 2/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ PRMT1 Q99873 2/20 0.39
▸ ENPP3 O14638 1/20 0.39
▸ ENTPD3 O75355 1/20 0.39
▸ NR1I2 O75469 1/20 0.39
▸ USP2 O75604 1/20 0.39
▸ PRKD3 O94806 1/20 0.39

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
SCHEMBL11354660 0.94 MEN1 (0.46) MEN1MAPTKMT2ATDP1RAB9A
SCHEMBL10908373 0.91 CASP6 (0.43) MEN1MAPTKMT2ATDP1RAB9A
SCHEMBL10909117 0.91 MEN1 (0.46) MEN1MAPTKMT2ATDP1RAB9A
SCHEMBL11433965 0.87 CASP6 (0.48) MEN1MAPTKMT2ATDP1RAB9A
SCHEMBL11427527 0.85 CASP6 (0.48) MEN1MAPTKMT2ATDP1RAB9A
SCHEMBL11339174 0.85 HPSE (0.46) MEN1MAPTKMT2ATDP1RAB9A
SCHEMBL11354729 0.85 PRMT1 (0.44) MEN1MAPTKMT2ATDP1RAB9A
SCHEMBL10905294 0.84 CASP6 (0.55) KMT2ACASP6CTDSP1APEX1PRMT1
SCHEMBL11425435 0.83 POLB (0.50) MEN1MAPTKMT2ATDP1RAB9A
SCHEMBL10907672 0.83 CASP6 (0.65) MEN1MAPTKMT2ATDP1CASP6

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
US-4599204-A Oxalylamides useful as dental antiplaque agents and inhibitors of connective tissue destruction AMERICAN CYANAMID COMPANY (US) 1986-07-08 — — US disclosed
Send feedback