SCHEMBL14764832

SCHEMBL14764832

CCCCC(N)(CC=O)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ARG1 P05089 13/20 0.43
ARG2 P78540 11/20 0.43
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
CYP1A2 P05177 1/20 0.41
THRB P10828 1/20 0.41
KMT2A Q03164 1/20 0.41
ODC1 P11926 1/20 0.40
FDPS P14324 2/20 0.38
TSHR P16473 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
SCHEMBL185635 0.83 ARG1 (0.52) ARG1ARG2MEN1ALDH1A1CYP1A2
SCHEMBL28798096 0.83 ARG2 (0.42) ARG1ARG2MEN1ALDH1A1CYP1A2
SCHEMBL1916175 0.82 ARG2 (0.53) ARG1ARG2MEN1ALDH1A1CYP1A2
SCHEMBL29635608 0.80 TSHR (0.50) ARG1ARG2MEN1ALDH1A1CYP1A2
SCHEMBL7362369 0.80 ARG1 (0.39) ARG1ARG2MEN1ALDH1A1CYP1A2
SCHEMBL14764494 0.80 FDPS (0.35) ARG1ARG2MEN1KMT2AFDPS
SCHEMBL23010905 0.79 ARG1 (0.48) ARG1ARG2MEN1ALDH1A1CYP1A2
SCHEMBL6666220 0.79 ARG2 (0.63) ARG1ARG2MEN1ALDH1A1CYP1A2
SCHEMBL14764529 0.79 MEN1 (0.52) ARG1ARG2MEN1ALDH1A1CYP1A2
SCHEMBL7465019 0.79 ARG2 (0.63) ARG1ARG2MEN1ALDH1A1CYP1A2

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-8835373-B2 Fluid fabric enhancer compositions THE PROCTER & GAMBLE COMPANY (US) 2014-09-16 US disclosed
CN-101861150-B Antifungal agents MERCK & CO INC 2014-07-16 CN disclosed
US-20130065813-A1 FLUID FABRIC ENHANCER COMPOSITIONS THE PROCTER & GAMBLE COMPANY 2013-03-14 US disclosed
CN-101861150-A Antifungal preparation MERCK & CO INC 2010-10-13 CN disclosed