SCHEMBL26313646

SCHEMBL26313646

CCCN(Cc1cc(Cl)ccc1C#N)c1ccccc1Cl

nearest known ligand 0.50

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NOS2 P35228 19/20 0.50
NOS1 P29475 16/20 0.50
NOS3 P29474 15/20 0.50
PGR P06401 1/20 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
SCHEMBL26313813 0.87 NOS2 (0.42) NOS2NOS1NOS3
Hydrochloric Acid SCHEMBL25410821 0.86 NOS2 (0.41) NOS2NOS1NOS3
SCHEMBL26313647 0.84 NOS2 (0.52) NOS2NOS1NOS3PGR
SCHEMBL26313668 0.83 CRHR1 (0.40) NOS2NOS1NOS3
SCHEMBL25409199 0.80 NOS2 (0.40) NOS2NOS1NOS3PGR
SCHEMBL25414063 0.79 ADRA1D (0.39) NOS2NOS1NOS3PGR
SCHEMBL26313798 0.77 IDO1 (0.43) NOS2
SCHEMBL30597303 0.77 IDO1 (0.43) NOS2
SCHEMBL30433862 0.73 ALDH3A1 (0.51)
SCHEMBL26313650 0.73 GPBAR1 (0.43) NOS2NOS1NOS3

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-20230286913-A1 INHIBITORS OF NITRIC OXIDE SYNTHASES (NOS), PHARMACEUTICAL PRODUCTS THEREOF, AND METHODS THEREOF Gacter Inc. (US) 2023-09-14 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-20230286913-A1 INHIBITORS OF NITRIC OXIDE SYNTHASES (NOS), PHARMACEUTICAL PRODUCTS THEREOF, AND METHODS THEREOF NOS1, NOS3, NOS2 NOS2 3/4885NOS1 1/4885NOS3 2/4885

“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.