SCHEMBL11140902

SCHEMBL11140902

C=CCNC(CCC)S(=O)(=O)O

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.33
HDAC7 Q8WUI4 1/20 0.31
HDAC8 Q9BY41 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
HDAC9 Q9UKV0 1/20 0.31
HDAC5 Q9UQL6 1/20 0.31
ALDH1A1 P00352 1/20 0.31
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CHRM1 P11229 1/20 0.30
AKR1A1 P14550 1/20 0.30
CHRM3 P20309 1/20 0.30
HTR2A P28223 1/20 0.30
HTR2C P28335 1/20 0.30
ADRA1A P35348 1/20 0.30
HRH1 P35367 1/20 0.30
DRD3 P35462 1/20 0.30
SLC6A3 Q01959 1/20 0.30
HDAC1 Q13547 1/20 0.30
HDAC2 Q92769 1/20 0.30

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
SCHEMBL28876330 0.89 FAAH (0.38) FAAHALDH1A1CA1CA2
SCHEMBL1119819 0.85 FAAH (0.31) FAAH
SCHEMBL7032509 0.78 HDAC7 (0.37) HDAC7HDAC8HDAC6HDAC9HDAC5
SCHEMBL2360061 0.74
SCHEMBL22551588 0.73 TP53 (0.42) ALDH1A1CA1CA2
SCHEMBL21623888 0.73 CA2 (0.40) HDAC7HDAC8HDAC6HDAC9HDAC5
SCHEMBL21951 0.73 TSHR (0.44) HDAC7HDAC8HDAC6HDAC9HDAC5
Hydrochloric Acid SCHEMBL28130618 0.72 FAAH (0.32) FAAHHDAC7HDAC8HDAC6HDAC9
SCHEMBL4956064 0.72 SLC6A4 (0.32)
Ammonia Solution, Strong SCHEMBL139207 0.71 TSHR (0.42) HDAC7HDAC8HDAC6HDAC9HDAC5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0027284-B1 COPOLYMER LATEX AND PHOTOGRAPHIC SILVER HALIDE MATERIALS CONTAINING SUCH LATEX AGFA-GEVAERT N.V. (BE) 1983-09-14 EP disclosed
EP-0010335-B1 EMULSIFIER-FREE LATEXES AND PHOTOGRAPHIC LIGHT-SENSITIVE ELEMENTS CONTAINING THEM AGFA-GEVAERT N.V. (BE) 1982-07-28 EP disclosed
US-4340664-A Copolymer latex and photographic silver halide materials containing such latex AGFA-GEVAERT, N.V. (BE) 1982-07-20 US disclosed
EP-0027284-A1 Copolymer latex and photographic silver halide materials containing such latex AGFA-GEVAERT N.V. (BE) 1981-04-22 EP disclosed
US-4245036-A SAID LATEX COMPRISING A POLYMER OF ETHYL ACRYLATE AND AN IONOBENIC MODIFIER AGFA-GEVAERT N.V. (BE) 1981-01-13 US disclosed
EP-0010335-A1 Emulsifier-free latexes and photographic light-sensitive elements containing them AGFA-GEVAERT N.V. (BE) 1980-04-30 EP disclosed