SCHEMBL29035112

SCHEMBL29035112

N=C(NO)c1csc(CN)c1

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
DAO P14920 2/20 0.34
TP53 P04637 1/20 0.30
RAB9A P51151 1/20 0.30

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 SCHEMBL25364781 0.98 DAO (0.33) DAO
SCHEMBL25364950 0.80 DAO (0.41) DAOTP53RAB9A
SCHEMBL25364331 0.80 DAO (0.31) DAO
SCHEMBL1738243 0.79 F10 (0.42) DAO
SCHEMBL25363448 0.78 LOX (0.35) DAOTP53RAB9A
Hydrochloric Acid SCHEMBL25365653 0.78 DAO (0.37) DAOTP53RAB9A
SCHEMBL25364110 0.77 DAO (0.39) DAOTP53RAB9A
SCHEMBL25363519 0.77 MEN1 (0.33) DAORAB9A
Hydrochloric Acid SCHEMBL25364185 0.77 LOX (0.34) DAO
SCHEMBL25364323 0.77 DAO (0.36) DAOTP53RAB9A

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
CN-116437913-A Pharmaceutical compounds for treating complement-mediated disorders 艾其林医药公司 2023-07-14 CN disclosed