SCHEMBL8989941

SCHEMBL8989941

Cc1ccc(S(=O)(=O)N(c2ccc(Cl)cc2C(=O)c2ccccc2Cl)C(C)(C)C(N)=O)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
C5AR1 P21730 2/20 0.53
RECQL P46063 1/20 0.44
LMNA P02545 2/20 0.40
HTT P42858 1/20 0.40
PSEN1 P49768 6/20 0.40
PSEN2 P49810 6/20 0.40
APH1B Q8WW43 6/20 0.40
NCSTN Q92542 6/20 0.40
APH1A Q96BI3 6/20 0.40
PSENEN Q9NZ42 6/20 0.40
THRB P10828 1/20 0.39
GABRP O00591 2/20 0.38
GABRD O14764 2/20 0.38
GABRA1 P14867 2/20 0.38
GABRB1 P18505 2/20 0.38
GABRG2 P18507 2/20 0.38
GABRB3 P28472 2/20 0.38
GABRA5 P31644 2/20 0.38
GABRA3 P34903 2/20 0.38
GABRA2 P47869 2/20 0.38

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
SCHEMBL8989955 0.80 PSEN1 (0.44) C5AR1LMNAPSEN1PSEN2APH1B
SCHEMBL8989945 0.76 C5AR1 (0.56) C5AR1RECQLPSEN1PSEN2APH1B
SCHEMBL8990081 0.75 C5AR1 (0.53) C5AR1RECQLLMNAHTTPSEN1
SCHEMBL8989915 0.72 C5AR1 (0.51) C5AR1LMNAHTTPSEN1PSEN2
SCHEMBL8989887 0.70 LMNA (0.77) LMNAHTT
SCHEMBL11181058 0.70 C5AR1 (1.00) C5AR1LMNAHTTTHRBGABRP
SCHEMBL3253202 0.69 C5AR1 (0.55) C5AR1RECQLLMNAFLT1FLT4
SCHEMBL18575488 0.69 C5AR1 (0.55) C5AR1LMNAHTTPSEN1PSEN2
SCHEMBL6553189 0.69 C5AR1 (0.70) C5AR1LMNAHTTPSEN1PSEN2
SCHEMBL29208625 0.68 C5AR1 (0.48) C5AR1LMNAHTTPSEN1PSEN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5578633-A VASOPRESSIN AND OXYTOCIN ANTAGONISTS SANOFI (FR) 1996-11-26 US disclosed
US-5481005-A N-sulfonylindoline derivatives, their preparation and the pharmaceutical compositions in which they are present SANOFI (FR) 1996-01-02 US disclosed
US-5397801-A Affinity for vasopressin and ocytocin receptors; disorders of nervous, cardiovascular and gastrointestinal systems SANOFI (FR) 1995-03-14 US disclosed
US-5338755-A Have affinity for vasopressin and ocytocin receptors; intermediates for drugs that act on central nervous system ELF SANOFI (FR) 1994-08-16 US disclosed