SCHEMBL11596703

SCHEMBL11596703

CCCCN(CCCC)S(=O)(=O)c1cc(Cl)cc(Cl)c1C=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ VCAM1 P19320 3/20 0.44
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ POLB P06746 1/20 0.37
▸ ACLY P53396 2/20 0.37
▸ ALDH1A1 P00352 2/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37
▸ PSEN1 P49768 2/20 0.36
▸ PSEN2 P49810 2/20 0.36
▸ APH1B Q8WW43 2/20 0.36
▸ NCSTN Q92542 2/20 0.36
▸ APH1A Q96BI3 2/20 0.36
▸ PSENEN Q9NZ42 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ LMNA P02545 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ TSHR P16473 2/20 0.35
▸ THRB P10828 1/20 0.35
▸ MEN1 O00255 1/20 0.35

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
SCHEMBL11595452 0.77 ALDH1A1 (0.46) ACLYALDH1A1MAPTL3MBTL1TSHR
SCHEMBL8910908 0.72 VCAM1 (0.50) VCAM1ALDH1A1NPSR1PSEN1PSEN2
SCHEMBL11595168 0.72 TSHR (0.52) SMN1; SMN2POLBACLYALDH1A1KMT2A
SCHEMBL11740334 0.72 ACLY (0.48) VCAM1ACLYTHRB
SCHEMBL9305533 0.71 HTT (0.54) VCAM1SMN1; SMN2ALDH1A1KMT2ALMNA
SCHEMBL10687962 0.71 ALDH1A1 (0.47) VCAM1SMN1; SMN2POLBALDH1A1NPSR1
SCHEMBL11670822 0.70 VCAM1 (0.45) VCAM1SMN1; SMN2POLBALDH1A1NPSR1
SCHEMBL199133 0.69 PSEN1 (0.43) VCAM1SMN1; SMN2POLBALDH1A1PSEN1
SCHEMBL9520453 0.69 CTRC (0.37) POLBACLYALDH1A1KMT2AL3MBTL1
SCHEMBL11742822 0.69 THRB (0.46) VCAM1THRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4118232-A Photographic material containing sulphonic acid group containing disazo dyestuffs CIBA-GEIGY AG (CH) 1978-10-03 — — US disclosed
US-4051123-A Sulfonic-acid-group containing disazo dyestuffs CIBA-GEIGY AG (CH) 1977-09-27 — — US disclosed
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