SCHEMBL9148082

SCHEMBL9148082

Nc1ccc(OC(=O)c2ccc(C(=O)Oc3ccccc3)cc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP10 Q53GL7 1/20 0.68
KMT2A Q03164 5/20 0.63
PRSS1 P07477 4/20 0.63
F2 P00734 3/20 0.63
PRSS2 P07478 3/20 0.63
PRSS3 P35030 3/20 0.63
PKM P14618 2/20 0.63
TMPRSS15 P98073 2/20 0.60
ACR P10323 1/20 0.60
MAPT P10636 5/20 0.56
MEN1 O00255 2/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
LMNA P02545 1/20 0.56
TP53 P04637 1/20 0.56
CYP3A4 P08684 1/20 0.56
ADORA3 P0DMS8 1/20 0.56
CHRM1 P11229 1/20 0.56
TBXA2R P21731 1/20 0.56
SLC6A2 P23975 1/20 0.56
PDE4A P27815 1/20 0.56

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
SCHEMBL451331 0.98 PARP10 (0.65) PARP10KMT2APRSS1F2PRSS2
SCHEMBL3136588 0.95 PARP10 (0.62) PARP10KMT2APRSS1F2PRSS2
Nitrogen SCHEMBL27803609 0.94 PARP10 (0.61) PARP10KMT2APRSS1F2PRSS2
SCHEMBL5710341 0.94 PARP10 (0.70) PARP10KMT2APRSS1F2PRSS2
Aminobenzoic Acid SCHEMBL31416072 0.93 PARP10 (0.59) PARP10KMT2APRSS1F2PRSS2
SCHEMBL107649 0.92 PRSS1 (0.71) PARP10KMT2APRSS1F2PRSS2
SCHEMBL346698 0.92 PRSS1 (0.71) PARP10KMT2APRSS1F2PRSS2
SCHEMBL347429 0.92 PRSS1 (0.71) PARP10KMT2APRSS1F2PRSS2
SCHEMBL8585571 0.89 PRSS1 (0.63) PARP10KMT2APRSS1F2PRSS2
SCHEMBL9003587 0.89 PRSS1 (0.63) PARP10KMT2APRSS1F2PRSS2

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-5414125-A Epoxy resin curing agent THE DOW CHEMICAL COMPANY (US) 1995-05-09 US disclosed