SCHEMBL3423800

SCHEMBL3423800

[NH]C(=O)c1ccc(CO)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PRSS1 P07477 2/20 0.54
▸ PRSS2 P07478 1/20 0.54
▸ PRSS3 P35030 1/20 0.54
▸ EPHX2 P34913 1/20 0.46
▸ TSHR P16473 1/20 0.42
▸ CA1 P00915 3/20 0.41
▸ CA2 P00918 3/20 0.41
▸ CA12 O43570 1/20 0.41
▸ CA4 P22748 1/20 0.41
▸ CA6 P23280 1/20 0.41
▸ CA5A P35218 1/20 0.41
▸ CA7 P43166 1/20 0.41
▸ CA9 Q16790 1/20 0.41
▸ CA14 Q9ULX7 1/20 0.41
▸ CA5B Q9Y2D0 1/20 0.41
▸ F2 P00734 1/20 0.40
▸ PLG P00747 1/20 0.40
▸ PLAU P00749 1/20 0.40
▸ PLAT P00750 1/20 0.40
▸ KLKB1 P03952 1/20 0.40

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
SCHEMBL8186531 0.79 PRSS1 (0.52) PRSS1PRSS2PRSS3EPHX2TSHR
SCHEMBL9743495 0.78 KMT2A (0.38) PRSS1PRSS2PRSS3CA1CA2
SCHEMBL2489734 0.78 ALDH1A1 (0.64) PRSS1F2PLGPLAUPLAT
SCHEMBL3417750 0.78 CA1 (0.61) PRSS1PRSS2PRSS3CA1CA2
SCHEMBL4603744 0.78 LOXL2 (0.58) PRSS1PRSS2PRSS3CA1CA2
SCHEMBL16280136 0.77 PRSS1 (0.50) PRSS1PRSS2PRSS3EPHX2TSHR
SCHEMBL49984 0.77 TSHR (0.63) PRSS1PRSS2PRSS3TSHRCA1
Terephthalic Acid SCHEMBL28358133 0.77 TSHR (0.63) PRSS1PRSS2PRSS3TSHRCA1
Terephthalic Acid SCHEMBL28453225 0.77 TSHR (0.63) PRSS1PRSS2PRSS3TSHRCA1
SCHEMBL3424224 0.75 PRSS1 (0.43) PRSS1PRSS2PRSS3TSHRCA1

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-2226637-A1 Cross-linking agents on solid medium Centre National de la Recherche Scientifique (CNRS) (FR) 2010-09-08 — — EP disclosed
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