SCHEMBL7433812

SCHEMBL7433812

N=C(N)c1cccc(C=O)c1

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
UNG P13051 1/20 0.60
F2 P00734 5/20 0.55
F10 P00742 4/20 0.55
PRSS1 P07477 6/20 0.52
PRSS2 P07478 6/20 0.52
PRSS3 P35030 6/20 0.52
C1S P09871 1/20 0.52
PLG P00747 1/20 0.52
LOXL2 Q9Y4K0 1/20 0.48
F12 P00748 1/20 0.46
F7 P08709 1/20 0.46
F3 P13726 1/20 0.46
PKM P14618 1/20 0.46
NOS1 P29475 1/20 0.46
ALDH1A1 P00352 1/20 0.45

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
Hydrochloric Acid SCHEMBL6816751 0.98 UNG (0.58) UNGF2F10PRSS1PRSS2
SCHEMBL9335857 0.85 UNG (0.45) UNGF2F10PRSS1PRSS2
SCHEMBL29958104 0.82 UNG (0.68) UNGALDH1A1
SCHEMBL9326770 0.82 PRSS1 (0.53) F2F10PRSS1PRSS2PRSS3
SCHEMBL723945 0.82 UNG (0.68) UNGALDH1A1
SCHEMBL4687383 0.80 TRIM24 (0.66) UNGF2PRSS1PRSS2PRSS3
SCHEMBL9323598 0.80 PRSS1 (0.52) F2F10PRSS1PRSS2PRSS3
SCHEMBL19737184 0.80 UNG (0.60) UNGF2F10ALDH1A1
SCHEMBL4680429 0.79 UNG (0.54) UNGF2F10ALDH1A1
SCHEMBL7346348 0.79 PLAU (0.56) F2F10PRSS1PRSS2PRSS3

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
US-5633381-A ANTICOAGULANTS BERLEX LABORATORIES, INC. 1997-05-27 US disclosed