SCHEMBL30912751

SCHEMBL30912751

Nc1nc(N)c2c(Cl)cccc2n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
DHFR P00374 8/20 0.66
DCPS Q96C86 2/20 0.57
KCNH2 Q12809 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
SCHEMBL8390061 1.00 DHFR (0.66) DHFRDCPSKCNH2
SCHEMBL21497073 0.84 DHFR (0.49) DHFRDCPSKCNH2
SCHEMBL13975517 0.81 DHFR (0.50) DHFRDCPSKCNH2
SCHEMBL10690347 0.79 DCPS (0.59) DHFRDCPSKCNH2
SCHEMBL1154870 0.78 DCPS (0.58) DHFRDCPSKCNH2
SCHEMBL12391891 0.77 EGFR (0.63) DHFR
SCHEMBL30912748 0.76 DHFR (0.57) DHFRDCPSKCNH2
SCHEMBL29740318 0.76 DCPS (0.61) DHFRDCPSKCNH2
SCHEMBL2127622 0.76 DHFR (0.57) DHFRDCPSKCNH2
SCHEMBL29224081 0.76 DCPS (0.56) DHFRDCPSKCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118142359-A Anti-pollution and oxidation-resistant reverse osmosis membrane with low-surface-energy coating and preparation method thereof 万华化学集团股份有限公司 2024-06-07 CN claimed
CN-118613484-A Antifolate linker-drug and antibody-drug conjugates 拜奥迪斯私人有限公司 2024-09-06 CN disclosed
CN-118142359-A Anti-pollution and oxidation-resistant reverse osmosis membrane with low-surface-energy coating and preparation method thereof 万华化学集团股份有限公司 2024-06-07 CN disclosed