SCHEMBL2808428

SCHEMBL2808428

OCc1nc2cnc3cc(Br)ccc3c2s1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 2/20 0.38
MEN1 O00255 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
KMT2A Q03164 1/20 0.38
PTGES O14684 12/20 0.36
HDAC6 Q9UBN7 1/20 0.35
CYP1A2 P05177 1/20 0.32
CYP2C19 P33261 1/20 0.32
HTT P42858 1/20 0.32
SLC22A12 Q96S37 1/20 0.32
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31

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
SCHEMBL4969106 0.83 NPC1 (0.37) MEN1NPC1RAB9AKMT2APTGES
SCHEMBL5144794 0.83 TLR8 (0.41) PTGESHTTLMNAMAPT
SCHEMBL26968810 0.81 TLR8 (0.43) NPC1RAB9APTGESHTTLMNA
SCHEMBL29877302 0.81 TLR8 (0.43) NPC1RAB9APTGESHTTLMNA
SCHEMBL5146450 0.80 MEN1 (0.35) MEN1NPC1RAB9AKMT2APTGES
SCHEMBL5146679 0.80 PTGES (0.33) MEN1NPC1RAB9AKMT2APTGES
SCHEMBL4965121 0.80 CYP1A2 (0.47) MEN1NPC1RAB9AKMT2APTGES
SCHEMBL2812875 0.79 NPC1 (0.37) MEN1NPC1RAB9AKMT2APTGES
SCHEMBL5146603 0.75 TLR8 (0.49) TRPV1PTGES
SCHEMBL23037587 0.75 PDPK1 (0.42)

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 TRPV1 3218/4885MEN1 3807/4885NPC1 4507/4885

“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.