SCHEMBL3658178

SCHEMBL3658178

C=CCNCCNCCNCC(=O)O

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.39
ABCC4 O15439 1/20 0.39
KDM4E B2RXH2 6/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.34
TSHR P16473 1/20 0.34
ALDH1A1 P00352 4/20 0.34
GAA P10253 2/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
KMT2A Q03164 1/20 0.34
POLB P06746 1/20 0.33

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
SCHEMBL1551332 0.98 MAPT (0.40) MAPTABCC4KDM4ECA1CA2
Hydrochloric Acid SCHEMBL437244 0.96 MAPT (0.39) MAPTABCC4KDM4ECA1CA2
SCHEMBL3435875 0.89 MAPT (0.42) MAPTABCC4KDM4EHTTSMN1; SMN2
SCHEMBL29438 0.86
SCHEMBL3946913 0.86 MAPT (0.44) MAPTABCC4KDM4ESMN1; SMN2TSHR
SCHEMBL7184515 0.84
SCHEMBL10869584 0.84
Hydrochloric Acid SCHEMBL4732743 0.84
Water SCHEMBL7160929 0.84
Ammonia Solution, Strong SCHEMBL28182267 0.84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024024920-A1 OPHTHALMIC COMPOSITION マルホ株式会社 2024-02-01 WO disclosed
US-20170056335-A1 Ophthalmic Composition RHOTO PHARMACEUTICAL CO., LTD. (JP) 2017-03-02 US disclosed
EP-1865049-B1 CLEANING AGENT FOR THERMOSTATIC CHAMBERS WAKO PURE CHEM IND LTD (JP) 2014-08-06 EP disclosed
US-7727949-B2 Cleaning agent for thermostatic chambers WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2010-06-01 US disclosed
US-20080214420-A1 Cleaning Agent for Thermostatic Chambers FUJIFILM WAKO PURE CHEMICAL CORPORATION (JP) 2008-09-04 US disclosed
EP-1865049-A1 CLEANING AGENT FOR THERMOSTATIC CHAMBERS Wako Pure Chemical Industries, Ltd. (JP) 2007-12-12 EP disclosed
EP-0392250-A1 Liquid preservative RIEDEL-DE HAEN AKTIENGESELLSCHAFT (DE) 1990-10-17 EP disclosed