SCHEMBL10869749

SCHEMBL10869749

CCCCC(N)(C(=O)O)S(C)(=O)=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FDPS P14324 3/20 0.39
ALDH1A1 P00352 2/20 0.34
GGT1 P19440 1/20 0.34
MEN1 O00255 1/20 0.34
CYP1A2 P05177 1/20 0.34
THRB P10828 1/20 0.34
KMT2A Q03164 1/20 0.34
SMPD1 P17405 2/20 0.33
ARG1 P05089 2/20 0.33
ARG2 P78540 2/20 0.33
ALOX15 P16050 1/20 0.32
AKR1B1 P15121 1/20 0.32
GPR84 Q9NQS5 2/20 0.31
PPARG P37231 2/20 0.31
PPARD Q03181 2/20 0.31
PPARA Q07869 2/20 0.31
TSHR P16473 1/20 0.31
SLC22A6 Q4U2R8 1/20 0.31
SLC22A8 Q8TCC7 1/20 0.31
TLR2 O60603 1/20 0.31

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
SCHEMBL28791221 0.84 FDPS (0.39) FDPSALDH1A1GGT1MEN1CYP1A2
SCHEMBL17541354 0.82 ODC1 (0.40) FDPSALDH1A1GGT1MEN1THRB
SCHEMBL12503924 0.79 MEN1 (0.39) ALDH1A1GGT1MEN1CYP1A2THRB
SCHEMBL27363350 0.77 SMPD1 (0.43) FDPSALDH1A1MEN1KMT2ASMPD1
SCHEMBL9567300 0.72 ALDH1A1 (0.32) FDPSALDH1A1MEN1KMT2AALOX15
SCHEMBL185635 0.72 ARG1 (0.52) FDPSALDH1A1MEN1CYP1A2THRB
SCHEMBL288685 0.72 FDPS (0.46) FDPSALDH1A1MEN1CYP1A2THRB
SCHEMBL27561926 0.71 ALDH1A1 (0.36) FDPSALDH1A1GGT1MEN1CYP1A2
SCHEMBL5029032 0.70 FDPS (0.45) FDPSALDH1A1MEN1CYP1A2THRB
SCHEMBL18124758 0.70 ARG1 (0.59) FDPSALDH1A1GGT1MEN1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0179332-A2 ZNS-active peptides acting on the cholinergetic system HOECHST AKTIENGESELLSCHAFT (DE) 1986-04-30 EP disclosed