Benzaldehyde

Benzaldehyde

SCHEMBL6717653

Nc1cccc(-c2c(Cl)nc(Cl)c(=O)n2CC(=O)OCc2ccccc2)c1.O=Cc1ccccc1

nearest known ligand 0.49

Full drug profile on Sugi Atlas →

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
F7 P08709 16/20 0.49
F2 P00734 7/20 0.49
F10 P00742 2/20 0.49
F3 P13726 6/20 0.44
PRSS1 P07477 7/20 0.43
PRSS2 P07478 6/20 0.43
PRSS3 P35030 6/20 0.43
CYP1A2 P05177 2/20 0.38
CYP2C9 P11712 2/20 0.38
CYP2C19 P33261 2/20 0.38

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
SCHEMBL5847414 0.94 F7 (0.51) F7F2F10F3PRSS1
Hydrochloric Acid SCHEMBL5846292 0.93 F7 (0.51) F7F2F10F3PRSS1
SCHEMBL5847197 0.83 CYP1A2 (0.48) F7F2F3PRSS1CYP1A2
SCHEMBL14537324 0.81 F2 (0.50) F7F2F3CYP1A2CYP2C9
SCHEMBL5847925 0.80 F2 (0.49) F7F2F10F3CYP1A2
SCHEMBL5846166 0.79 F2 (0.50) F7F2F3CYP1A2CYP2C9
SCHEMBL5846183 0.78 F2 (0.51) F7F2F3
SCHEMBL30765979 0.73 F2 (0.45) F7F2F3CYP1A2CYP2C9
SCHEMBL23460740 0.72 F7 (0.58) F7F2F3PRSS1
SCHEMBL3240576 0.72 MEN1 (0.44) CYP1A2CYP2C9CYP2C19

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-20040102448-A1 Substituted polycyclic aryl and heteroaryl pyrazinones useful for selective inhibition of the coagulation cascade PHARMACIA CORPORATION 2004-05-27 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040102448-A1 Substituted polycyclic aryl and heteroaryl pyrazinones useful for selective inhibition of the coagulation cascade TFPI, PLAT, TFPI2 F7 75/4885F2 6/4885F10 58/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.