SCHEMBL7799071

SCHEMBL7799071

NCCC(N)(C(=O)O)N1C(=O)c2ccccc2C1=O

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 1/20 0.42
▸ CA9 Q16790 1/20 0.42
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ L3MBTL1 Q9Y468 2/20 0.40
▸ ALDH1A1 P00352 4/20 0.38
▸ POLB P06746 2/20 0.38
▸ KDM4E B2RXH2 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37
▸ GAA P10253 1/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ CYP2C9 P11712 1/20 0.36
▸ TSHR P16473 1/20 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
SCHEMBL7199054 0.87 CA12 (0.44) CA12CA9MEN1KMT2AL3MBTL1
SCHEMBL29132821 0.86 CA12 (0.45) CA12CA9MEN1KMT2AL3MBTL1
SCHEMBL29132820 0.86 CA12 (0.45) CA12CA9MEN1KMT2AL3MBTL1
SCHEMBL1569082 0.71 L3MBTL1 (0.36) CA12CA9MEN1KMT2AL3MBTL1
SCHEMBL1568214 0.70 RPS6KA2 (0.36) MEN1KMT2AL3MBTL1ALDH1A1MAPT
SCHEMBL5706500 0.70 CA12 (0.47) CA12CA9MEN1KMT2AL3MBTL1
SCHEMBL1567872 0.69 POLB (0.35) CA12CA9ALDH1A1POLBCYP1A2
SCHEMBL29470155 0.68 CA12 (0.46) CA12CA9MEN1KMT2AL3MBTL1
SCHEMBL1568241 0.68 ALDH1A1 (0.35) MEN1KMT2AALDH1A1KDM4ERAB9A
SCHEMBL18183830 0.67 CA12 (0.44) CA12CA9MEN1KMT2AL3MBTL1

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-1088020-A1 FUNCTIONALISED POLYMERS OF ALPHA-AMINO ACIDS AND THE METHOD OF PREPARATION THEREOF USTAV MAKROMOLEKULARNI CHEMIE AKADEMIE VED CESKE REPUBLIKY (CZ) 2001-04-04 — — EP claimed
WO-1999064495-A1 FUNCTIONALISED POLYMERS OF α-AMINO ACIDS AND THE METHOD OF PREPARATION THEREOF ÚSTAV MAKROMOLEKULÁRNÍ CHEMIE AKADEMIE VĚD ČESKÉ REPUBLIKY (CZ) 1999-12-16 — — WO claimed
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