SCHEMBL8674474

SCHEMBL8674474

NC1(NC(=O)c2ccccc2)C=CC=CC1S(=O)(=O)O.[NaH]

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.41
KMT2A Q03164 3/20 0.36
ALDH1A1 P00352 3/20 0.36
MAPT P10636 3/20 0.36
MEN1 O00255 2/20 0.36
MAOA P21397 1/20 0.36
KDM4E B2RXH2 1/20 0.36
APAF1 O14727 1/20 0.36
TDP2 O95551 1/20 0.36
NSD2 O96028 1/20 0.36
ABL1 P00519 1/20 0.36
HSP90AA1 P07900 1/20 0.36
HSP90AB1 P08238 1/20 0.36
CASP3 P42574 1/20 0.36
HTT P42858 1/20 0.36
GALK1 P51570 1/20 0.36
BLM P54132 1/20 0.36
PPP1CA P62136 1/20 0.36
RIN1 Q13671 1/20 0.36
SENP8 Q96LD8 1/20 0.36

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
SCHEMBL11684778 0.77 FAAH (0.42) FAAHKMT2AALDH1A1MAPTMEN1
SCHEMBL10447280 0.75
SCHEMBL11483529 0.72
SCHEMBL1143476 0.71 KDM4E (0.31) MAPTKDM4E
SCHEMBL11483523 0.69
SCHEMBL9843108 0.67
SCHEMBL8858048 0.66 CYP2C19 (0.46) FAAHKMT2AALDH1A1MAPTMEN1
SCHEMBL18691848 0.65 ALDH1A1 (0.36) FAAHKMT2AALDH1A1MAPTMEN1
SCHEMBL29987487 0.65 TSHR (0.31) HTT
SCHEMBL7782761 0.65 L3MBTL1 (0.36) MAPTHTTBLML3MBTL1CYP2C19

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-5786476-A UV absorbers, their preparation and use CIBA SPECIALTY CHEMICALS CORPORATION (US) 1998-07-28 US disclosed