SCHEMBL8100666

SCHEMBL8100666

COCCOCCCCN(CCCCOCCOC)CCCCOCCOC

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
BCHE P06276 1/20 0.38
ACHE P22303 1/20 0.38
MEN1 O00255 1/20 0.33
THRB P10828 1/20 0.33
HTT P42858 1/20 0.33
KMT2A Q03164 1/20 0.33
MAPT P10636 1/20 0.33
CA2 P00918 2/20 0.32
CYP3A4 P08684 1/20 0.32
TSHR P16473 1/20 0.32
ALDH1A1 P00352 1/20 0.32
EPHX2 P34913 2/20 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
SCHEMBL2921308 0.92 CA2 (0.33) BCHEACHEMEN1THRBHTT
SCHEMBL24585375 0.89 CA2 (0.36) BCHEACHEMEN1THRBHTT
SCHEMBL14723685 0.89 CA2 (0.36) BCHEACHEMEN1THRBHTT
SCHEMBL26147368 0.88 BLM (0.37) BCHEACHEMEN1KMT2ACA2
SCHEMBL24178237 0.88 CA2 (0.38) BCHEACHEMEN1KMT2ACA2
SCHEMBL24178239 0.85 BLM (0.38) MEN1KMT2ACA2
SCHEMBL5616049 0.84 ALDH1A1 (0.39) ALDH1A1
SCHEMBL11995932 0.84 MEN1 (0.42) MEN1THRBHTTKMT2AMAPT
SCHEMBL11995937 0.84 MEN1 (0.42) MEN1THRBHTTKMT2AMAPT
SCHEMBL16598028 0.84 MEN1 (0.42) 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
US-6147249-A ESTER COMPOUND CAPABLE OF FORMING ACID-DECOMPOSABLE POLYMER WHICH CAN BE BLENDED AS BASE RESIN TO FORMULATE RESIST COMPOSITION HAVING HIGHER SENSITIVITY, RESOLUTION AND ETCHING RESISTANCE THAN CONVENTIONAL RESIST COMPOSITIONS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2000-11-14 US disclosed