SCHEMBL8573174

SCHEMBL8573174

CC[C](CO)N(CC)CC

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EHMT2 Q96KQ7 3/20 0.35
EHMT1 Q9H9B1 3/20 0.35
ABCB11 O95342 2/20 0.35
HTT P42858 2/20 0.35
GSDMD P57764 2/20 0.35
CA12 O43570 2/20 0.35
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
CA4 P22748 2/20 0.35
CA9 Q16790 2/20 0.35
CYP2E1 P05181 1/20 0.35
PTGS1 P23219 1/20 0.35
ALDH1A1 P00352 2/20 0.33
ALDH2 P05091 2/20 0.33
LMNA P02545 2/20 0.33
PHGDH O43175 2/20 0.33
MGLL Q99685 2/20 0.33
PLIN1 O60240 1/20 0.33
GMNN O75496 1/20 0.33
TRPA1 O75762 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
SCHEMBL7080083 0.71
SCHEMBL408418 0.62
SCHEMBL4277454 0.62 ALDH1A1 (0.42) CA12CA1CA2CA9ALDH1A1
Hydrochloric Acid SCHEMBL25340335 0.61 LMNA (0.55) EHMT2EHMT1ABCB11HTTGSDMD
SCHEMBL4409866 0.60 TDP1 (0.31) ALDH1A1TSHR
SCHEMBL25424890 0.60 CA12 (0.44) EHMT2EHMT1ABCB11HTTGSDMD
SCHEMBL8440401 0.60
SCHEMBL2167597 0.60 EHMT2 (0.38) EHMT2EHMT1ABCB11HTTGSDMD
SCHEMBL4624030 0.60
SCHEMBL8248539 0.58

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-5808052-A ANIONIC CELLULOSES; WATER SOLUBLE DRILLING FLUIDS WOLFF WALSRODE AG (DE) 1998-09-15 US disclosed