SCHEMBL2812875

SCHEMBL2812875

CC(C)=NOCc1nc2cnc3cc(Br)ccc3c2s1

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.37
RAB9A P51151 3/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.31
LMNA P02545 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
PTGES O14684 5/20 0.31
TSHR P16473 2/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
HTT P42858 1/20 0.31
DYRK1A Q13627 1/20 0.30
MPO P05164 1/20 0.30

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
SCHEMBL4965121 0.83 CYP1A2 (0.47) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL4969106 0.82 NPC1 (0.37) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL5146450 0.81 MEN1 (0.35) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL2809369 0.80 TLR8 (0.44) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL2808428 0.79 TRPV1 (0.38) NPC1RAB9AMEN1KMT2ALMNA
SCHEMBL5144794 0.77 TLR8 (0.41) LMNAL3MBTL1PTGESHTT
SCHEMBL5146679 0.76 PTGES (0.33) NPC1RAB9AMEN1KMT2APTGES
SCHEMBL26968810 0.75 TLR8 (0.43) NPC1RAB9ASMN1; SMN2LMNAL3MBTL1
SCHEMBL29877302 0.75 TLR8 (0.43) NPC1RAB9ASMN1; SMN2LMNAL3MBTL1
SCHEMBL2806238 0.72 PTGES (0.37) NPC1RAB9AMEN1KMT2APTGES

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8378102-B2 Oxime and hydroxylamine substituted thiazolo[4,5-c] ring compounds and methods 3M INNOVATIVE PROPERTIES COMPANY (US) 2013-02-19 US disclosed
US-20100240693-A1 Oxime and Hydroxylamine Substituted Thiazolo [4,5-C] Ring Compounds and Methods COLEY PHARMACEUTICAL GROUP, INC (US) 2010-09-23 US disclosed
EP-1877056-A2 OXIME AND HYDROXYLAMINE SUBSTITUTED THIAZOLOÝ4,5-C¨RING COMPOUNDS AND METHODS Coley Pharmaceutical Group, Inc. (US) 2008-01-16 EP disclosed
WO-2007120121-A2 OXIME AND HYDROXYLAMINE SUBSTITUTED THIAZOLO[4,5-C] RING COMPOUNDS AND METHODS COLEY PHARMACEUTICAL GROUP, INC. (US) 2007-10-25 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100240693-A1 Oxime and Hydroxylamine Substituted Thiazolo [4,5-C] Ring Compounds and Methods IL4, IL2, TH NPC1 4507/4885RAB9A 4402/4885MEN1 3807/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.