SCHEMBL213299

SCHEMBL213299

O=S(=O)(ON=C(c1ccccn1)c1ccccn1)c1ccccc1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.74
ALDH1A1 P00352 6/20 0.74
KMT2A Q03164 2/20 0.74
MAPT P10636 2/20 0.51
PTGS2 P35354 1/20 0.48
LMNA P02545 1/20 0.44
NAPRT Q6XQN6 1/20 0.44
P4HTM Q9NXG6 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
AGTR1 P30556 1/20 0.42
NPC1 O15118 1/20 0.42
MITF O75030 1/20 0.42
PKM P14618 1/20 0.42
RAB9A P51151 1/20 0.42
CDK5 Q00535 1/20 0.42
CDK5R1 Q15078 1/20 0.42
CES2 O00748 1/20 0.42
CES1 P23141 1/20 0.42
GAA P10253 1/20 0.40
HPGD P15428 1/20 0.40

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
SCHEMBL12329014 0.93 KDM4E (0.68) KDM4EALDH1A1KMT2AMAPTPTGS2
SCHEMBL17257470 0.85 KDM4E (0.56) KDM4EALDH1A1KMT2AMAPTPTGS2
SCHEMBL211993 0.85 KDM4E (0.70) KDM4EALDH1A1KMT2AMAPTPTGS2
SCHEMBL213778 0.76 MAPT (0.55) KDM4EALDH1A1KMT2AMAPTLMNA
SCHEMBL14395584 0.76 KDM4E (0.58) KDM4EALDH1A1KMT2AMAPTPTGS2
SCHEMBL9528646 0.74 CES2 (0.50) KDM4EALDH1A1KMT2AMAPTLMNA
SCHEMBL2048632 0.71 MAPT (0.53) KDM4EALDH1A1KMT2AMAPTLMNA
SCHEMBL213055 0.71 KDM4E (0.50) KDM4EALDH1A1KMT2AMAPTLMNA
SCHEMBL2048635 0.71 MAPT (0.53) KDM4EALDH1A1KMT2AMAPTLMNA
SCHEMBL212968 0.71 MAPT (0.53) KDM4EALDH1A1KMT2AMAPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120077941-A1 POLYMERS FUNCTIONALIZED WITH PROTECTED OXIME COMPOUNDS BRIDGESTONE CORPORATION (JP) 2012-03-29 US claimed
US-8088868-B2 oximation of cojugated homopolymers formed by addtion polymerization of conjugated diene monomer in the presence lanthanide copmpounds as polymerization catalysts; polymers used in the manufacture of tires having reduced hysteresis BRIDGESTONE CORPORATION (JP) 2012-01-03 US claimed
US-20080146745-A1 POLYMERS FUNCTIONALIZED WITH PROTECTED OXIME COMPOUNDS BRIDGESTONE CORPORATION (JP) 2008-06-19 US claimed