SCHEMBL15720170

SCHEMBL15720170

CS(C)(=O)=Nc1cccc([N+](=O)[O-])c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.53
LMNA P02545 1/20 0.53
KMT2A Q03164 3/20 0.51
GAA P10253 2/20 0.51
HTT P42858 1/20 0.51
ALDH1A1 P00352 8/20 0.50
MAPT P10636 4/20 0.50
MEN1 O00255 2/20 0.50
MAPK1 P28482 1/20 0.50
ACHE P22303 1/20 0.50
NPC1 O15118 1/20 0.49
CASP3 P42574 1/20 0.49
RAB9A P51151 1/20 0.49
SENP8 Q96LD8 1/20 0.49
SENP7 Q9BQF6 1/20 0.49
SENP6 Q9GZR1 1/20 0.49
HTR3E A5X5Y0 1/20 0.49
HTR3B O95264 1/20 0.49
HTR3A P46098 1/20 0.49
HTR3D Q70Z44 1/20 0.49

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
SCHEMBL4579124 0.78 NOS1 (0.52) ALDH1A1ACHECA2CA5AF2
SCHEMBL5827608 0.78 TSHR (0.61) TSHRLMNAKMT2AGAAHTT
SCHEMBL1405487 0.77 TSHR (0.67) TSHRLMNAKMT2AALDH1A1MAPT
SCHEMBL1405486 0.77 TSHR (0.67) TSHRLMNAKMT2AALDH1A1MAPT
SCHEMBL3189908 0.77 TSHR (0.67) TSHRLMNAKMT2AGAAHTT
Dinitrophenylene SCHEMBL28595103 0.76 TSHR (0.71) TSHRLMNAKMT2AGAAHTT
SCHEMBL11359659 0.76 TSHR (0.64) TSHRLMNAKMT2AGAAHTT
SCHEMBL7335956 0.76 TSHR (0.64) TSHRLMNAKMT2AGAAHTT
SCHEMBL18118419 0.74 TSHR (0.61) TSHRLMNAKMT2AGAAHTT
SCHEMBL6568954 0.74 TSHR (0.61) TSHRLMNAKMT2AGAAHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113717162-A Urea derivatives as kinase inhibitors 奥苏拉收购有限公司 2021-11-30 CN disclosed
US-9890185-B2 Urea derivatives useful as kinase inhibitors RESPIVERT LIMITED (GB) 2018-02-13 US disclosed
US-9732063-B2 Kinase inhibitors RESPIVERT LIMITED (GB) 2017-08-15 US disclosed
US-20160318958-A1 UREA DERIVATIVES USEFUL AS KINASE INHIBITORS OXULAR ACQUISITIONS LIMITED (GB) 2016-11-03 US disclosed
EP-2925742-B1 KINASE INHIBITORS RESPIVERT LTD (GB) 2016-10-26 EP disclosed
EP-3083604-A1 UREA DERIVATIVES USEFUL AS KINASE INHIBITORS Respivert Limited (GB) 2016-10-26 EP disclosed
US-20150329523-A1 KINASE INHIBITORS OXULAR ACQUISITIONS LIMITED (GB) 2015-11-19 US disclosed
EP-2925742-A1 KINASE INHIBITORS Respivert Limited (GB) 2015-10-07 EP disclosed
WO-2015092423-A1 UREA DERIVATIVES USEFUL AS KINASE INHIBITORS RESPIVERT LIMITED (GB) 2015-06-25 WO disclosed
WO-2014076484-A1 KINASE INHIBITORS RESPIVERT LIMITED (GB) 2014-05-22 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 (2 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-20160318958-A1 UREA DERIVATIVES USEFUL AS KINASE INHIBITORS SYK, UACA, YES1 TSHR 1885/4885LMNA 3198/4885KMT2A 2216/4885
US-20150329523-A1 KINASE INHIBITORS SYK, SRC, BTK TSHR 1905/4885LMNA 4313/4885KMT2A 3728/4885

“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.