Itaconate

Itaconate

SCHEMBL4886808

C=C(CC(=O)O)C(=O)O.C=CC(C(=O)O)C1CCN(C=C)C1=O

nearest known ligand 0.40

Full drug profile on Sugi Atlas →

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.40
HSD17B10 Q99714 1/20 0.40

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
SCHEMBL247979 0.87 FAAH (0.31)
SCHEMBL9194849 0.80 FAAH (0.33)
SCHEMBL5198799 0.69 CPN1 (0.33)
Itaconate SCHEMBL17687381 0.69 ALOX15 (0.47) ALOX15HSD17B10
SCHEMBL8406695 0.65 ACE (0.32)
SCHEMBL692314 0.65 ACE (0.39)
SCHEMBL21348424 0.63 FAAH (0.32)
Itaconate SCHEMBL28837947 0.62 ALOX15 (0.39) ALOX15HSD17B10
SCHEMBL646545 0.62 ACHE (0.32)
Itaconate SCHEMBL4294336 0.62 ALOX15 (0.77) ALOX15HSD17B10

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
US-20150342861-A1 HAIR PRODUCT WITH STABLE VISCOSITY THE DIAL CORPORATION 2015-12-03 US disclosed
US-20150104404-A1 POLYMER SYNERGY FOR IMPROVED HAIR STYLING THE DIAL CORPORATION (US) 2015-04-16 US disclosed
US-20130142746-A1 PRESSURIZED DELIVERY OF HAIR STYLING GELS THE DIAL CORPORATION (US) 2013-06-06 US disclosed
US-20080102051-A1 Such as sorbitol and/or mannitol; holding power, durability, flexibility; flaking resistance HENKEL KGAA 2008-05-01 US disclosed