SCHEMBL28189869

SCHEMBL28189869

CNNc1nc(N)nc(N)n1

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.33
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA9 Q16790 1/20 0.31
CASP1 P29466 1/20 0.31
NUDT1 P36639 2/20 0.31

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
SCHEMBL28812800 0.82 CA1 (0.40) LMNACA12CA1CA2CA9
SCHEMBL20614567 0.78 ALDH1A1 (0.30)
SCHEMBL9910 0.77 ALDH1A1 (0.40) LMNACA12CA1CA2CA9
SCHEMBL22030226 0.77 CA1 (0.33) LMNACA12CA1CA2CA9
SCHEMBL23175172 0.76 MEN1 (0.47) LMNANUDT1
Hydrochloric Acid SCHEMBL11061003 0.74 ALDH1A1 (0.39) LMNACA12CA1CA2CA9
SCHEMBL11394714 0.74 ALDH1A1 (0.39) LMNACA12CA1CA2CA9
SCHEMBL25422725 0.74 ALDH1A1 (0.42) LMNACA12CA1CA2CA9
Ammonia Solution, Strong SCHEMBL28937474 0.74 ALDH1A1 (0.39) LMNACA12CA1CA2CA9
Water SCHEMBL14861606 0.74 ALDH1A1 (0.39) LMNACA12CA1CA2CA9

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109152798-A Antibodies specific for glycosylated PD-1 and methods of use thereof 斯特库比股份有限公司 2019-01-04 CN disclosed
CN-107530429-A Antibodies specific for glycosylated PD-L1 and methods of use thereof 斯特库比股份有限公司 2018-01-02 CN disclosed