SCHEMBL430659

SCHEMBL430659

CC[C@@H](C(=O)O)N(C)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.46
GLA P06280 1/20 0.46
TSHR P16473 1/20 0.46
KMT2A Q03164 5/20 0.41
MEN1 O00255 4/20 0.41
SLC6A2 P23975 3/20 0.41
SLC6A4 P31645 3/20 0.41
TP53 P04637 2/20 0.41
POLB P06746 1/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
LMNA P02545 1/20 0.40
NPSR1 Q6W5P4 1/20 0.39
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
HTT P42858 1/20 0.38
CHRNB2 P17787 1/20 0.37
CHRNB4 P30926 1/20 0.37

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
SCHEMBL430660 1.00 ALDH1A1 (0.46) ALDH1A1GLATSHRKMT2AMEN1
SCHEMBL679865 0.85 ALDH1A1 (0.41) ALDH1A1GLATSHRKMT2AMEN1
SCHEMBL27820012 0.85 ALDH1A1 (0.41) ALDH1A1GLATSHRKMT2AMEN1
SCHEMBL4564576 0.85 ALDH1A1 (0.41) ALDH1A1GLATSHRKMT2AMEN1
SCHEMBL21518498 0.84 SLC6A2 (0.41) TSHRKMT2ASLC6A2SLC6A4TP53
SCHEMBL3143071 0.83 ALDH1A1 (0.49) ALDH1A1TSHRLMNACYP3A4
SCHEMBL29173918 0.83 SLC6A2 (0.46) ALDH1A1GLASLC6A2SLC6A4TP53
SCHEMBL11042753 0.83 CPA3 (0.42) ALDH1A1GLATSHRKMT2ASLC6A2
SCHEMBL28130586 0.83 SLC6A2 (0.51) ALDH1A1GLATSHRKMT2AMEN1
SCHEMBL27761276 0.83 ALDH1A1 (0.45) ALDH1A1GLATSHRKMT2ASLC6A2

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

Appears in 2281 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3383359-B1 A FRAGRANCE COMPOSITION SYMRISE AG (DE) 2022-08-03 EP claimed
US-11352587-B2 Fragrance mixtures SYMRISE AG (DE) 2022-06-07 US claimed
US-20200297610-A1 FRAGRANCE COMPOSITION SYMRISE AG (DE) 2020-09-24 US claimed
US-20180344605-A1 A FRAGRANCE COMPOSITION SYMRISE AG (DE) 2018-12-06 US claimed
EP-3383359-A1 A FRAGRANCE COMPOSITION Symrise AG (DE) 2018-10-10 EP claimed
WO-2017097434-A1 A FRAGRANCE COMPOSITION SYMRISE AG (DE) 2017-06-15 WO claimed
WO-2017097438-A1 A FRAGRANCE COMPOSITION SYMRISE AG (DE) 2017-06-15 WO claimed
EP-1660621-B1 AGENTS THAT ARE ABSORBED BY THE SURFACE OF SUBSTRATES HENKEL AG & CO KGAA (DE) 2012-02-01 EP claimed
EP-1660621-A1 AGENTS THAT ARE ABSORBED BY THE SURFACE OF SUBSTRATES Henkel Kommanditgesellschaft auf Aktien (DE) 2006-05-31 EP claimed
WO-2005019400-A1 AGENTS THAT ARE ABSORBED BY THE SURFACE OF SUBSTRATES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2005-03-03 WO claimed
EP-1062164-B1 CONTAINER FOR AQUEOUS HYPOCHLORITE-BASED BLEACHING AGENTS HENKEL KGAA (DE) 2003-07-23 EP claimed
EP-1252284-A2 FRAGRANCE TABLETS Cognis Deutschland GmbH & Co. KG (DE) 2002-10-30 EP claimed
WO-2001057167-A2 FRAGRANCE TABLETS COGNIS DEUTSCHLAND GMBH & CO. KG (DE) 2001-08-09 WO claimed
EP-3442354-B1 FORMULATION AND PRODUCTION OF SPINACH EXTRACT WITH BETA ECDYSON DR GOETZ GMBH (DE) 2026-05-20 EP disclosed
EP-3454825-B1 AROMA PREPARATIONS CONTAINING MENTHOL SYMRISE AG (DE) 2026-05-06 EP disclosed
EP-4073218-B1 WASHING AND CLEANING AGENTS COMPRISING ENVIRONMENTALLY COMPATIBLE MICROCAPSULES HENKEL AG & CO KGAA (DE) 2026-04-15 EP disclosed
WO-1999006518-A1 THICKENED AQUEOUS TENSIDE SOLUTIONS COGNIS DEUTSCHLAND GMBH (DE) 1999-02-11 WO disclosed
EP-0893490-A2 Nitrogen-free fabric softener Henkel Kommanditgesellschaft auf Aktien (DE) 1999-01-27 EP disclosed
EP-0834551-A2 Fixing of fragrances containing detergent compositions to surfaces Henkel Kommanditgesellschaft auf Aktien (DE) 1998-04-08 EP disclosed
EP-0813862-A2 Perfume oil concentrates in the form of transparent aqueous microemulsions Henkel Kommanditgesellschaft auf Aktien (DE) 1997-12-29 EP disclosed