SCHEMBL22861896

SCHEMBL22861896

CC(CNc1ccc2c(c1S(=O)(=O)O)Oc1c(Cl)c3c(c(Cl)c1=N2)Oc1c(ccc(NCC(Cl)Nc2nc(F)nc(Nc4ccccc4S(=O)(=O)O)n2)c1S(=O)(=O)O)N=3)Nc1nc(F)nc(Nc2ccccc2S(=O)(=O)O)n1

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ HPGDS O60760 1/20 0.32

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
SCHEMBL21284462 0.96 HPGDS (0.34) HPGDS
SCHEMBL12172883 0.90 HPGDS (0.40) HPGDS
SCHEMBL12172868 0.81 CHAT (0.34) HPGDS
SCHEMBL14468810 0.80 KCNH3 (0.31) —
SCHEMBL14468962 0.80 KCNH3 (0.31) —
SCHEMBL14468746 0.79 CA12 (0.31) —
SCHEMBL16330354 0.78 — —
SCHEMBL12974477 0.77 HPGDS (0.34) HPGDS
SCHEMBL5319374 0.76 — —
SCHEMBL14468779 0.75 CA12 (0.34) —

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-20210002735-A1 Process for the Simultaneous Tanning and Dyeing of Collagen Containing Fibrous Material HUNTSMAN ADVANCED MATERIALS (SWITZERLAND) GMBH (CH) 2021-01-07 — — US disclosed
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