SCHEMBL624318

SCHEMBL624318

CCCCCCCCCCCCCCCCCCCCCC(C)(C)N=O

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GGPS1 O95749 7/20 0.46
FDPS P14324 11/20 0.45
SMPD1 P17405 5/20 0.43
LPAR1 Q92633 1/20 0.43
LPAR3 Q9UBY5 1/20 0.43
TSHR P16473 1/20 0.40
THRB P10828 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
SCHEMBL409270 1.00 GGPS1 (0.46) GGPS1FDPSSMPD1LPAR1LPAR3
SCHEMBL27338 1.00 GGPS1 (0.46) GGPS1FDPSSMPD1LPAR1LPAR3
SCHEMBL3968198 1.00 GGPS1 (0.46) GGPS1FDPSSMPD1LPAR1LPAR3
SCHEMBL17941454 1.00 GGPS1 (0.46) GGPS1FDPSSMPD1LPAR1LPAR3
SCHEMBL319204 1.00 GGPS1 (0.46) GGPS1FDPSSMPD1LPAR1LPAR3
SCHEMBL8674346 1.00 GGPS1 (0.46) GGPS1FDPSSMPD1LPAR1LPAR3
SCHEMBL1262744 1.00 GGPS1 (0.46) GGPS1FDPSSMPD1LPAR1LPAR3
SCHEMBL4436183 1.00 GGPS1 (0.46) GGPS1FDPSSMPD1LPAR1LPAR3
SCHEMBL7083334 1.00 GGPS1 (0.46) GGPS1FDPSSMPD1LPAR1LPAR3
SCHEMBL11151578 1.00 GGPS1 (0.46) GGPS1FDPSSMPD1LPAR1LPAR3

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-3728537-A1 CLEANING AGENTS CONTAINING AMINE OXIDE AND COMPRISING SYNERGISTICALLY ACTING PROTEASES AND AMYLASES Henkel AG & Co. KGaA (DE) 2020-10-28 EP disclosed
EP-3728536-A1 CLEANING AGENT CONTAINING AMYLASE WHICH IS STABILIZED USING BETAINE Henkel AG & Co. KGaA (DE) 2020-10-28 EP disclosed
EP-2603075-A2 AGRICULTURAL PESTICIDE COMPOSITIONS Rhodia Operations (FR) 2013-06-19 EP disclosed
WO-2012021164-A2 AGRICULTURAL PESTICIDE COMPOSITIONS RHODIA OPERATIONS (FR) 2012-02-16 WO disclosed