SCHEMBL13844915

SCHEMBL13844915

O=C(CO)c1ccc(CO)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PRSS1 P07477 1/20 0.48
▸ PRSS2 P07478 1/20 0.48
▸ PRSS3 P35030 1/20 0.48
▸ MMP2 P08253 1/20 0.46
▸ MMP9 P14780 1/20 0.46
▸ MMP8 P22894 1/20 0.46
▸ EPHX2 P34913 1/20 0.42
▸ TSHR P16473 1/20 0.42
▸ L3MBTL1 Q9Y468 3/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ ABL1 P00519 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ ALPI P09923 1/20 0.41
▸ GAA P10253 1/20 0.41
▸ ALPG P10696 1/20 0.41
▸ APEX1 P27695 1/20 0.41
▸ CASP3 P42574 1/20 0.41
▸ RECQL P46063 1/20 0.41
▸ BLM P54132 1/20 0.41

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
SCHEMBL30694356 0.87 KDM4E (0.50) TSHRL3MBTL1KDM4EALDH1A1ABL1
SCHEMBL14230567 0.85 MAPT (0.54) PRSS1PRSS2PRSS3MMP2MMP9
Benzyl Alcohol SCHEMBL27296147 0.84 TSHR (0.61) TSHRL3MBTL1KDM4EALDH1A1CASP3
SCHEMBL13080503 0.81 CES2 (0.55) TSHRL3MBTL1KDM4EALDH1A1ABL1
SCHEMBL10789202 0.81 PRSS1 (0.50) PRSS1PRSS2PRSS3MMP2MMP9
SCHEMBL13831355 0.81 RAB9A (0.39) L3MBTL1KDM4EALDH1A1ABL1POLB
SCHEMBL16263584 0.81 HDAC3 (0.55) PRSS1PRSS2PRSS3KDM4ECA12
SCHEMBL1365349 0.81 GSK3B (0.61) PRSS1PRSS2PRSS3MMP2MMP9
SCHEMBL8122311 0.81 ALDH1A1 (0.61) L3MBTL1KDM4EALDH1A1TDP1NPC1
SCHEMBL9234729 0.81 MAPT (0.55) PRSS1PRSS2PRSS3MMP2MMP9

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
EP-1317464-B1 FLUORESCENT NUCLEOBASE CONJUGATES HAVING ANIONIC LINKERS APPLERA CORP (US) 2009-05-13 — — EP disclosed
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