SCHEMBL5859668

SCHEMBL5859668

O=C(O)CCCCCCNS(=O)(=O)CCCCc1cccc(Cl)c1

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 1/20 0.56
▸ KMT2A Q03164 3/20 0.52
▸ ALDH1A1 P00352 2/20 0.52
▸ FABP4 P15090 2/20 0.50
▸ PLAAT3 P53816 1/20 0.49
▸ PLAAT5 Q96KN8 1/20 0.49
▸ PLAAT2 Q9NWW9 1/20 0.49
▸ PLAAT4 Q9UL19 1/20 0.49
▸ RXFP1 Q9HBX9 2/20 0.48
▸ MAPT P10636 1/20 0.48
▸ TBXA2R P21731 2/20 0.47
▸ AKR1C3 P42330 1/20 0.46
▸ MEN1 O00255 1/20 0.46

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
SCHEMBL18126611 0.84 MAPT (0.66) SMN1; SMN2KMT2AALDH1A1PLAAT3PLAAT5
SCHEMBL7829175 0.83 SMN1; SMN2 (0.67) SMN1; SMN2KMT2AALDH1A1PLAAT3PLAAT5
SCHEMBL5859621 0.79 AKR1C3 (0.43) SMN1; SMN2KMT2AALDH1A1PLAAT3PLAAT5
SCHEMBL5024832 0.79 SMN1; SMN2 (0.68) SMN1; SMN2KMT2AALDH1A1PLAAT3PLAAT5
SCHEMBL5860827 0.76 TACR1 (0.42) KMT2AALDH1A1FABP4RXFP1MAPT
SCHEMBL11850224 0.76 PTGFR (0.57) KMT2AALDH1A1FABP4TBXA2R
Water SCHEMBL11730250 0.75 PTGFR (0.56) KMT2AALDH1A1FABP4TBXA2R
SCHEMBL11037045 0.75 PLAAT3 (0.58) SMN1; SMN2KMT2AALDH1A1PLAAT3PLAAT5
SCHEMBL4946092 0.75 SMN1; SMN2 (0.51) SMN1; SMN2KMT2AALDH1A1PLAAT3PLAAT5
SCHEMBL5859766 0.75 FABP4 (0.57) ALDH1A1FABP4TBXA2R

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-6998423-B2 Prevention of loss and restoration of bone mass by certain prostaglandin agonists PFIZER INC. (US) 2006-02-14 — — US claimed
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