SCHEMBL10608175

SCHEMBL10608175

CC(=O)NC(CCSSCC[C@H](NC(C)=O)C(=O)ON1C(=O)CCC1=O)C(=O)ON1C(=O)CCC1=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.38
▸ GAA P10253 2/20 0.38
▸ KDM4E B2RXH2 2/20 0.38
▸ MAPT P10636 2/20 0.38
▸ GLA P06280 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ CASP1 P29466 1/20 0.38
▸ CASP7 P55210 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ FNTA P49354 1/20 0.31
▸ FNTB P49356 1/20 0.31
▸ THRB P10828 1/20 0.31
▸ ALOX15 P16050 1/20 0.31
▸ NFKB1 P19838 1/20 0.31
▸ PTGS2 P35354 1/20 0.31
▸ THPO P40225 1/20 0.31
▸ RECQL P46063 1/20 0.31
▸ BLM P54132 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL29973774 0.84 TAS1R3 (0.39) ALDH1A1HPGDSMN1; SMN2
SCHEMBL10328000 0.81 FOLH1 (0.42) ALDH1A1KDM4EHPGDSMN1; SMN2
SCHEMBL13628932 0.81 KDM4E (0.32) ALDH1A1KDM4EMAPTTHRBALOX15
SCHEMBL30439625 0.81 KMT2A (0.39) ALDH1A1KDM4EMAPTCASP1THRB
SCHEMBL10600585 0.81 ALDH1A1 (0.49) ALDH1A1SMN1; SMN2
SCHEMBL17995308 0.78 ALDH1A1 (0.36) ALDH1A1GAAKDM4EMAPTGLA
SCHEMBL12509746 0.78 SIRT1 (0.38) ALDH1A1HPGDSMN1; SMN2
SCHEMBL21306392 0.77 CA12 (0.37) ALDH1A1GAAHPGDL3MBTL1
SCHEMBL8614577 0.77 CTSS (0.51) ALDH1A1KDM4EMAPTHPGDTSHR
SCHEMBL13927678 0.77 CTSS (0.51) ALDH1A1KDM4EMAPTHPGDTSHR

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-0131361-B1 COMPLEX OF BIOLOGICALLY ACTIVE PROTEIN WITH REACTIVE HIGH POLYMER HAVING BONDED THERETO BIFUNCTIONAL CHELATE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1989-10-18 — — EP disclosed
US-4556689-A POLYSUCCINIMIDE WITH BONDED AMINE RESIDUE OR DISULFIDE COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1985-12-03 — — US disclosed
Send feedback