SCHEMBL10030281

SCHEMBL10030281

CCC(C)(C)Oc1ccc(-c2ccc(Oc3ccc(S(=O)(=O)c4ccc(C(C)(C)CC)cc4)cc3)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.49
RAB9A P51151 4/20 0.49
MAPT P10636 1/20 0.49
POLB P06746 1/20 0.42
CYP2C9 P11712 1/20 0.42
SMN1; SMN2 Q16637 4/20 0.39
HTT P42858 3/20 0.39
PTPN1 P18031 1/20 0.38
HSD11B1 P28845 1/20 0.37
LMNA P02545 2/20 0.37
ELANE P08246 1/20 0.36
ALDH1A1 P00352 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MAOB P27338 5/20 0.36
HRH3 Q9Y5N1 5/20 0.36
PKM P14618 1/20 0.36
CASP1 P29466 1/20 0.35
BCL2L1 Q07817 1/20 0.35
MCL1 Q07820 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
SCHEMBL15932966 1.00 NPC1 (0.49) NPC1RAB9AMAPTPOLBCYP2C9
SCHEMBL10066693 0.96 NPC1 (0.53) NPC1RAB9AMAPTPOLBCYP2C9
SCHEMBL12463906 0.92 NPC1 (0.49) NPC1RAB9AMAPTPOLBCYP2C9
SCHEMBL10025072 0.92 NPC1 (0.45) NPC1RAB9AMAPTPOLBCYP2C9
SCHEMBL9891919 0.90 NPC1 (0.41) NPC1RAB9AMAPTPOLBCYP2C9
SCHEMBL13605583 0.90 HTT (0.43) NPC1RAB9AMAPTPOLBCYP2C9
SCHEMBL9915249 0.90 HTT (0.39) NPC1RAB9AMAPTPOLBSMN1; SMN2
SCHEMBL13064094 0.90 NPC1 (0.49) NPC1RAB9AMAPTPOLBCYP2C9
SCHEMBL14421288 0.88 NPC1 (0.45) NPC1RAB9AMAPTPOLBCYP2C9
SCHEMBL14364546 0.88 POLB (0.47) NPC1RAB9AMAPTPOLBCYP2C9

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-8141716-B2 Polysulfone and poly(N-vinyl lactam) polymer alloy and fiber and filter materials made of the alloy DONALDSON COMPANY, INC. (US) 2012-03-27 US disclosed
US-20110135901-A1 Polysulfone and poly(N-vinyl lactam) polymer alloy and fiber and filter materials made of the alloy DONALDSON COMPANY, INC. (US) 2011-06-09 US disclosed