SCHEMBL9255593

SCHEMBL9255593

O=C(Cl)C(C(=O)Cl)c1ccccc1C1CCCCC1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 5/20 0.44
PTGS2 P35354 1/20 0.37
PTGDR Q13258 3/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
CEL P19835 1/20 0.36
EPHX1 P07099 1/20 0.35
NAAA Q02083 1/20 0.35
KMO O15229 1/20 0.35
PTPRC P08575 1/20 0.35
PTPRF P10586 1/20 0.35
PTPN1 P18031 1/20 0.35
CDC25B P30305 1/20 0.35
PTGER2 P43116 1/20 0.35
ACMSD Q8TDX5 1/20 0.34
FFAR2 O15552 1/20 0.34
HDAC3 O15379 1/20 0.34
HDAC1 Q13547 1/20 0.34
ALDH1A1 P00352 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
SCHEMBL8540016 0.80 PTGDR2 (0.44) PTGDR2PTGS2PTGDRMEN1KMT2A
SCHEMBL8535772 0.78 PTGDR2 (0.42) PTGDR2PTGS2PTGDRMEN1KMT2A
SCHEMBL198311 0.77 PTGDR2 (0.48) PTGDR2PTGS2PTGDRMEN1KMT2A
SCHEMBL198081 0.77 PTGDR2 (0.48) PTGDR2PTGS2PTGDRMEN1KMT2A
SCHEMBL1825802 0.77 PTGDR2 (0.48) PTGDR2PTGS2PTGDRMEN1KMT2A
SCHEMBL30913266 0.77 PTGDR2 (0.48) PTGDR2PTGS2PTGDRMEN1KMT2A
SCHEMBL28336946 0.75 PTGDR2 (0.43) PTGDR2PTGS2PTGDRMEN1KMT2A
SCHEMBL28565924 0.75 PTGDR2 (0.47) PTGDR2PTGS2PTGDRMEN1KMT2A
SCHEMBL7919662 0.75 PTGDR2 (0.43) PTGDR2PTGS2MEN1KMT2AEPHX1
Hydrochloric Acid SCHEMBL8869405 0.75 PTGDR2 (0.47) PTGDR2PTGS2PTGDRMEN1KMT2A

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
US-5418244-A Antiperspirants, mydriatic UNIVERSITY OF FLORIDA (US) 1995-05-23 US disclosed