SCHEMBL10908478

SCHEMBL10908478

Cc1cc(C(=O)Nc2cc3cc(O)ccc3cc2S(=O)(=O)O)ccc1NC(=O)C(=O)Nc1ccc(C(=O)Nc2cc3cc(O)ccc3cc2S(=O)(=O)O)cc1C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 4/20 0.46
▸ MAPT P10636 4/20 0.46
▸ MEN1 O00255 3/20 0.46
▸ KMT2A Q03164 3/20 0.46
▸ TDP1 Q9NUW8 3/20 0.46
▸ LMNA P02545 1/20 0.46
▸ DHODH Q02127 1/20 0.45
▸ NPC1 O15118 3/20 0.43
▸ TAS1R3 Q7RTX0 1/20 0.42
▸ TAS1R1 Q7RTX1 1/20 0.42
▸ TAS1R2 Q8TE23 1/20 0.42
▸ THRB P10828 1/20 0.40
▸ ALDH1A1 P00352 3/20 0.40
▸ HTT P42858 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ TIMP3 P35625 2/20 0.37
▸ HPSE Q9Y251 2/20 0.37
▸ DEGS1 O15121 1/20 0.36
▸ CYP1A2 P05177 2/20 0.36
▸ HSD17B10 Q99714 2/20 0.36

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
SCHEMBL11342247 0.93 MAPT (0.46) RAB9AMAPTMEN1KMT2ATDP1
SCHEMBL11428018 0.87 MEN1 (0.44) RAB9AMAPTMEN1KMT2ATDP1
SCHEMBL11425953 0.84 MEN1 (0.44) RAB9AMAPTMEN1KMT2ATDP1
SCHEMBL10907481 0.84 DEGS1 (0.45) MAPTMEN1KMT2ATDP1ALDH1A1
SCHEMBL11423181 0.83 POLB (0.51) RAB9AMAPTMEN1KMT2ATDP1
SCHEMBL10907484 0.81 ENPP2 (0.45) RAB9AMAPTMEN1KMT2ATDP1
SCHEMBL10909166 0.81 ENPP2 (0.43) RAB9AMAPTMEN1KMT2ATDP1
SCHEMBL10909117 0.81 MEN1 (0.46) RAB9AMAPTMEN1KMT2ATDP1
SCHEMBL11422184 0.81 SMN1; SMN2 (0.56) RAB9AMAPTMEN1KMT2ATDP1
SCHEMBL10907688 0.81 KMT2A (0.46) RAB9AMAPTMEN1KMT2ATDP1

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
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