SCHEMBL5820538

SCHEMBL5820538

c1coc(-c2nnco2)n1

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 14/20 0.43
TSHR P16473 1/20 0.37
HPGDS O60760 1/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 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
SCHEMBL12906161 0.80 NOTUM (0.59) NOTUMTSHR
SCHEMBL100765 0.80 HPGDS (0.46) HPGDS
SCHEMBL28394924 0.70 NOTUM (0.50) NOTUMTSHR
SCHEMBL497217 0.67 NOTUM (0.44) NOTUMTSHRNPC1RAB9A
SCHEMBL722557 0.65 LTA4H (0.64) NOTUMHPGDS
SCHEMBL17694561 0.65 NOTUM (0.78) NOTUMTSHR
SCHEMBL5820537 0.65 HPGDS (0.34) HPGDS
SCHEMBL3407358 0.65 NOTUM (0.53) NOTUM
SCHEMBL26096222 0.65 NOTUM (0.44) NOTUMTSHRNPC1RAB9A
SCHEMBL6051817 0.64 NOTUM (0.41) NOTUMNPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113272293-A 2-amino-N-heteroaryl-nicotinamide as NAV1.8 inhibitors 默沙东公司 2021-08-17 CN disclosed
US-10179131-B2 Hepatitis B antiviral agents ENANTA PHARMACEUTICALS, INC. (US) 2019-01-15 US disclosed
US-20170194585-A1 ORGANIC MIXTURE, FORMULATION AND ORGANIC ELECTRONIC DEVICE COMPRISING THEREOF, AND THEIR APPLICATIONS GUANGZHOU CHINARAY OPTOELECTRONIC MATERIALS LTD. (CN) 2017-07-06 US disclosed
CN-106822153-A Method for suppressing amyotrophia 爱荷华大学研究基金会 2017-06-13 CN disclosed
US-20170084846-A1 Liquid Crystal Photoalignment Materials LOMOX LTD (GB) 2017-03-23 US disclosed
US-20170014408-A1 HEPATITIS B ANTIVIRAL AGENTS ENANTA PHARMACEUTICALS, INC. 2017-01-19 US disclosed
EP-2637659-B1 SGC STIMULATORS IRONWOOD PHARMACEUTICALS INC (US) 2016-05-18 EP disclosed
US-9061030-B2 sGC stimulators IRONWOOD PHARMACEUTICALS, INC. (US) 2015-06-23 US disclosed
CN-104688745-A Methods for inhibiting muscle atrophy UNIV IOWA RES FOUND 2015-06-10 CN disclosed
CN-103037692-B Methods for inhibiting muscle atrophy UNIV IOWA RES FOUND 2015-02-25 CN disclosed
CN-104080454-A Methods for inhibiting muscle atrophy UNIV IOWA RES FOUND 2014-10-01 CN disclosed
US-20140088071-A1 sGC STIMULATORS IRONWOOD PHARMACEUTICALS, INC. (US) 2014-03-27 US disclosed
US-20110020566-A1 Materials LOMOX LIMITED (GB) 2011-01-27 US disclosed
EP-1658069-A1 HETEROCYCLIC AMIDE DERIVATIVES WHICH POSSESS GLYCOGEN PHOSPHORYLASE INHIBITORY ACTIVITY Astrazeneca AB (SE) 2006-05-24 EP disclosed
WO-2005013981-A1 HETEROCYCLIC AMIDE DERIVATIVES WHICH POSSESS GLYCOGEN PHOSPHORYLASE INHIBITORY ACTIVITY ASTRAZENECA AB (SE) 2005-02-17 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 (4 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-20170014408-A1 HEPATITIS B ANTIVIRAL AGENTS HAVCR2, SLC10A1, HDGF NOTUM 1801/4885TSHR 4250/4885HPGDS 712/4885
US-20140088071-A1 sGC STIMULATORS PTGIS, GUCY1B1, GUCY1A1 NOTUM 3078/4885TSHR 1860/4885HPGDS 16/4885
US-10179131-B2 Hepatitis B antiviral agents HAVCR2, SLC10A1, HDGF NOTUM 1801/4885TSHR 4250/4885HPGDS 712/4885
US-20110020566-A1 Materials VIM, EPCAM, S100A4 NOTUM 4647/4885TSHR 4680/4885HPGDS 4403/4885

“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.