SCHEMBL9050811

SCHEMBL9050811

CCCCC=CCCOCCCCCCCC

nearest known ligand 0.67

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.50
THRB P10828 1/20 0.50
HTT P42858 1/20 0.50
KMT2A Q03164 1/20 0.50
MAPT P10636 1/20 0.50
LPAR2 Q9HBW0 3/20 0.48
LPAR3 Q9UBY5 3/20 0.48
LPAR1 Q92633 2/20 0.48
FAAH O00519 2/20 0.46
TRPV1 Q8NER1 1/20 0.46

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
SCHEMBL29073216 1.00 MEN1 (0.50) MEN1THRBHTTKMT2AMAPT
SCHEMBL29073197 0.91 MEN1 (0.50) MEN1THRBHTTKMT2AMAPT
SCHEMBL29073315 0.91 MEN1 (0.50) MEN1THRBHTTKMT2AMAPT
SCHEMBL1070643 0.91 LPAR1 (0.57) MEN1THRBHTTKMT2AMAPT
SCHEMBL44028 0.91 LPAR1 (0.57) MEN1THRBHTTKMT2AMAPT
SCHEMBL24398977 0.91 LPAR1 (0.57) MEN1THRBHTTKMT2AMAPT
SCHEMBL5364867 0.91 LPAR1 (0.57) MEN1THRBHTTKMT2AMAPT
SCHEMBL11576564 0.91 LPAR1 (0.57) MEN1THRBHTTKMT2AMAPT
SCHEMBL9751433 0.91 LPAR1 (0.57) MEN1THRBHTTKMT2AMAPT
SCHEMBL20774497 0.91 LPAR1 (0.57) MEN1THRBHTTKMT2AMAPT

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
WO-1996034921-A1 MINERAL OIL-FREE SOLVENT FOR ETHER-BASED PRINTING INKS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1996-11-07 WO disclosed