SCHEMBL8774985

SCHEMBL8774985

NC(=O)CCS(=O)(=O)CCCl

nearest known ligand 0.48

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
APEX1 P27695 1/20 0.44

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
SCHEMBL8774972 0.88 APEX1 (0.37) APEX1
SCHEMBL31513537 0.87 APEX1 (0.55) APEX1
SCHEMBL11335285 0.78 APEX1 (0.75) APEX1
SCHEMBL13923318 0.78 APEX1 (0.46) APEX1
SCHEMBL5673517 0.78 APEX1 (0.46) APEX1
SCHEMBL10805112 0.78 NPC1 (0.36)
Hydrochloric Acid SCHEMBL10537638 0.76 APEX1 (0.71) APEX1
SCHEMBL15110013 0.76 APEX1 (0.44) APEX1
SCHEMBL8774979 0.76 APEX1 (0.44) APEX1
SCHEMBL179830 0.76

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0574799-B1 Method for the preparation of fibre-reactive formazana dyes as well as aminophenols BASF AG (DE) 1997-09-17 EP disclosed
US-5536876-A Formylamino-aminophenol compounds and their use in preparation of fiber-reactive formazan dyes BASF AKTIENGESELLSCHAFT (DE) 1996-07-16 US disclosed
US-5410027-A Diazotization of a protectively formylated hydroxyphenylenediamine; coupling with a hydrazone compound; metallization; reacting with a halotriazine BASF AKTIENGESELLSCHAFT (DE) 1995-04-25 US disclosed
EP-0574799-A2 Method for the preparation of fibre-reactive formazana dyes as well as aminophenols BASF Aktiengesellschaft (DE) 1993-12-22 EP disclosed