SCHEMBL7460187

SCHEMBL7460187

CC(C)CCN(C[C@H](O)[CH]Cc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 7/20 0.48
RORC P51449 4/20 0.45
TAS2R14 Q9NYV8 2/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
CXCR3 P49682 1/20 0.45
POLB P06746 1/20 0.43
CNR1 P21554 1/20 0.43
CNR2 P34972 1/20 0.43
PSEN1 P49768 2/20 0.43
PSEN2 P49810 2/20 0.43
APH1B Q8WW43 2/20 0.43
NCSTN Q92542 2/20 0.43
APH1A Q96BI3 2/20 0.43
PSENEN Q9NZ42 2/20 0.43
TP53 P04637 1/20 0.42
ADAMTS5 Q9UNA0 1/20 0.42
SPPL2A Q8TCT8 1/20 0.41

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
SCHEMBL2585419 0.92 RORC (0.46) BACE1RORCTAS2R14CNR2ADAMTS5
SCHEMBL6473313 0.91 SPPL2A (0.50) BACE1RORCTAS2R14MEN1KMT2A
SCHEMBL2581195 0.82 TAS2R14 (0.51) BACE1RORCTAS2R14CNR2PSEN1
SCHEMBL2577597 0.81 TAS2R14 (0.50) RORCTAS2R14PSEN1PSEN2APH1B
SCHEMBL15157850 0.80 TAS2R14 (0.49) RORCTAS2R14CNR2PSEN1PSEN2
SCHEMBL8021812 0.80 SPPL2A (0.50) BACE1RORCTAS2R14CNR1PSEN1
SCHEMBL3575750 0.80 TAS2R14 (0.49) RORCTAS2R14KMT2ACNR1CNR2
SCHEMBL2579683 0.80 SPPL2A (0.50) BACE1RORCTAS2R14CNR1PSEN1
SCHEMBL2582228 0.79 MMP3 (0.53) RORCTAS2R14CNR2PSEN1PSEN2
SCHEMBL2580146 0.78 ADAMTS4 (0.50) BACE1TAS2R14CXCR3ADAMTS5

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
EP-0810209-B1 Alpha - and beta-amino acid hydroxyethylamino sulfonamides useful as retroviral protease inhibitors SEARLE & CO (US) 2002-06-05 EP claimed