SCHEMBL8223248

SCHEMBL8223248

NC(=O)c1cnc2cc3c(cc2c1)COO3

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HPGDS O60760 2/20 0.44
NNMT P40261 5/20 0.38
PSMD14 O00487 1/20 0.36
STAMBP O95630 1/20 0.36
COPS5 Q92905 1/20 0.36
MGAM O43451 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CHEK2 O96017 3/20 0.30
CHEK1 O14757 1/20 0.30
ALPL P05186 1/20 0.30

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
SCHEMBL8207634 0.87 MGAM (0.45) HPGDSPSMD14MGAM
SCHEMBL18009630 0.76 NNMT (0.43) HPGDSNNMTPSMD14STAMBPCOPS5
SCHEMBL17967334 0.71 HPGDS (0.54) HPGDSNNMTPSMD14STAMBPCOPS5
SCHEMBL7081027 0.69 HPGDS (0.53) HPGDSNNMTPSMD14STAMBPCOPS5
SCHEMBL528982 0.69 TSHR (0.51) SMN1; SMN2CHEK2CHEK1
SCHEMBL5405254 0.69 HPGDS (0.55) HPGDSNNMTPSMD14STAMBPCOPS5
Urea SCHEMBL6016094 0.67 MGAM (0.47) HPGDSPSMD14MGAMSMN1; SMN2CHEK2
SCHEMBL17967327 0.66 HPGDS (0.64) HPGDSNNMT
SCHEMBL16517720 0.64 HPGDS (0.50) HPGDSNNMTPSMD14STAMBPCOPS5
SCHEMBL29362497 0.64 MGAM (0.71) HPGDSPSMD14STAMBPCOPS5MGAM

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0975621-A1 CELL DIFFERENTIATION INDUCING AMIDE DERIVATIVES, THEIR PRODUCTION AND USE Takeda Chemical Industries, Ltd. (JP) 2000-02-02 EP disclosed
WO-1998049155-A1 CELL DIFFERENTIATION INDUCING AMIDE DERIVATIVES, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-11-05 WO disclosed