SCHEMBL7345170

SCHEMBL7345170

CC(=O)N(c1ccccc1)[C@@H](CCC(N)=O)C(=O)O.[Na]

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 2/20 0.40
MMP9 P14780 2/20 0.40
LMNA P02545 2/20 0.39
ALDH1A1 P00352 2/20 0.39
TP53 P04637 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
KMT2A Q03164 3/20 0.38
CA2 P00918 2/20 0.36
CA1 P00915 1/20 0.36
BLM P54132 2/20 0.36
PMP22 Q01453 2/20 0.36
ALOX15 P16050 1/20 0.36
MAPT P10636 2/20 0.35
POLB P06746 1/20 0.35
CYP3A4 P08684 1/20 0.35
PARP1 P09874 1/20 0.35
TSHR P16473 1/20 0.35
CYP2C19 P33261 1/20 0.35
RECQL P46063 1/20 0.35
HSD17B10 Q99714 1/20 0.35

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
SCHEMBL7342254 0.98 ALDH1A1 (0.40) MMP2MMP9LMNAALDH1A1TP53
SCHEMBL7342248 0.98 ALDH1A1 (0.40) MMP2MMP9LMNAALDH1A1TP53
SCHEMBL6464595 0.97 ALDH1A1 (0.39) MMP2MMP9LMNAALDH1A1TP53
SCHEMBL28294340 0.86 KMT2A (0.40) MMP2MMP9LMNAALDH1A1TP53
SCHEMBL7345167 0.86 LMNA (0.37) MMP2MMP9LMNAALDH1A1TP53
SCHEMBL6535237 0.84 SMN1; SMN2 (0.41) MMP2MMP9LMNAALDH1A1TP53
SCHEMBL29033834 0.83 ALDH1A1 (0.40) MMP2MMP9LMNAALDH1A1TP53
SCHEMBL757884 0.83 TP53 (0.48) MMP2MMP9LMNAALDH1A1TP53
SCHEMBL8429495 0.82 LMNA (0.39) MMP2MMP9LMNAALDH1A1TP53
SCHEMBL8429588 0.82 LMNA (0.39) MMP2MMP9LMNAALDH1A1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4559325-A ANTITUMOR AGENTS BURZYNSKI STANISLAW R (US) 1985-12-17 US disclosed
US-4558057-A URINE EXTRACTS BURZYNSKI STANISLAW R (US) 1985-12-10 US disclosed
US-4470970-A ANTITUMOR AND-CARCINOGENIC AGENT EXTRACTED FROM URINE BURZYNSKI STANISLAW R 1984-09-11 US disclosed
EP-0069232-A2 Pharmaceutical composition comprising phenyl acetyl glutamine,a combination of this compound with phenylacetic acid or 3-(phenylacetylamino)piperidine-2,6-dione,a process for isolating the latter from urine and a process for the synthesis of 3-(phenylacetylamino)piperidine-2,6-dione BURZYNSKI, Stanislaw R. (US) 1983-01-12 EP disclosed