SCHEMBL9154366

SCHEMBL9154366

CCCCCCN(Cc1ccc(F)cc1F)C(=O)C(C)(C)CCC

nearest known ligand 0.57

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 7/20 0.57
SOAT1 P35610 1/20 0.49
PPARG P37231 3/20 0.43
PPARA Q07869 3/20 0.43
PPARD Q03181 1/20 0.42

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
SCHEMBL4965873 0.81 SOAT1 (0.46) RIPK1SOAT1PPARGPPARAPPARD
SCHEMBL3963129 0.81 NPC1 (0.47) RIPK1SOAT1
SCHEMBL3963243 0.81 NPC1 (0.47) RIPK1SOAT1
SCHEMBL9340727 0.78 RIPK1 (0.44) RIPK1SOAT1PPARGPPARAPPARD
SCHEMBL17882243 0.77 RIPK1 (0.73) RIPK1
SCHEMBL4630764 0.74 SOAT1 (0.46) SOAT1PPARGPPARAPPARD
SCHEMBL29638047 0.73 RIPK1 (1.00) RIPK1
SCHEMBL17882301 0.73 RIPK1 (1.00) RIPK1
SCHEMBL9800261 0.73 RIPK1 (0.37) RIPK1SOAT1PPARGPPARA
SCHEMBL9337221 0.73 RIPK1 (0.46) RIPK1SOAT1PPARGPPARA

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
EP-0401166-B1 Nitrogen-containing titanocenes and their use CIBA GEIGY AG (CH) 1995-02-22 EP disclosed
US-5068371-A Photoinitiators for polymerization CIBA-GEIGY CORPORATION (US) 1991-11-26 US disclosed
EP-0401166-A2 Nitrogen-containing titanocenes and their use CIBA-GEIGY AG (CH) 1990-12-05 EP disclosed