SCHEMBL2850194

SCHEMBL2850194

O=C(NCl)N(c1ccccc1)c1ccccn1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 3/20 0.44
HTT P42858 3/20 0.44
PTGIR P43119 1/20 0.43
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
TP53 P04637 1/20 0.40
TSHR P16473 1/20 0.40
ALDH1A1 P00352 4/20 0.40
POLB P06746 3/20 0.40
KMT2A Q03164 3/20 0.40
MAPT P10636 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
KDM4E B2RXH2 1/20 0.40
MEN1 O00255 1/20 0.40
RECQL P46063 1/20 0.40
BLM P54132 1/20 0.40
MCL1 Q07820 1/20 0.40
CTDSP1 Q9GZU7 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
NPC1 O15118 2/20 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
SCHEMBL4359334 0.84 NPSR1 (0.56) NPSR1HTTPTGIRCA1CA2
SCHEMBL8892175 0.83 MEN1 (0.52) NPSR1HTTPTGIRCA1CA2
Hydrochloric Acid SCHEMBL27946914 0.82 NPSR1 (0.54) NPSR1HTTPTGIRCA1CA2
SCHEMBL10855054 0.81 NPSR1 (0.50) NPSR1HTTPTGIRTP53TSHR
SCHEMBL10668533 0.80 NPSR1 (0.63) NPSR1HTTPTGIRTP53TSHR
SCHEMBL19512684 0.78 NPSR1 (0.47) NPSR1HTTPTGIRTP53TSHR
SCHEMBL3475461 0.78 NPSR1 (0.47) NPSR1HTTPTGIRTP53TSHR
SCHEMBL9585211 0.78 NPSR1 (0.47) NPSR1HTTPTGIRTP53TSHR
SCHEMBL7980229 0.77 NPC1 (0.66) NPSR1HTTPTGIRTP53TSHR
SCHEMBL3831838 0.77 TSHR (0.56) NPSR1HTTPTGIRTP53TSHR

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
EP-3462876-B1 PLANT TREATMENT COMPOSITION CRODA INT PLC (GB) 2021-07-28 EP claimed
US-20190144350-A1 PLANT TREATMENT COMPOSITION CRODA INTERNATIONAL PLC (GB) 2019-05-16 US claimed
EP-3462876-A1 PLANT TREATMENT COMPOSITION Croda International PLC (GB) 2019-04-10 EP claimed
WO-2017208009-A1 PLANT TREATMENT COMPOSITION PLANT IMPACT PLC (GB) 2017-12-07 WO claimed
US-11629105-B2 Plant treatment composition CRODA INTERNATIONAL PLC (GB) 2023-04-18 US disclosed
EP-3462876-B1 PLANT TREATMENT COMPOSITION CRODA INT PLC (GB) 2021-07-28 EP disclosed
US-20190144350-A1 PLANT TREATMENT COMPOSITION CRODA INTERNATIONAL PLC (GB) 2019-05-16 US disclosed
EP-3462876-A1 PLANT TREATMENT COMPOSITION Croda International PLC (GB) 2019-04-10 EP disclosed
WO-2017208009-A1 PLANT TREATMENT COMPOSITION PLANT IMPACT PLC (GB) 2017-12-07 WO disclosed
CN-101243026-B Agricultural composition PLANT IMPACT PLC 2011-10-05 CN disclosed
US-7740680-B2 A water-soluble salt of calcium (nitrate, sulfate, chloride) and anauxin mimetic, N,N'-diphenyurea; fertilizers; increasing cellular integrity by preventing areas of local calcium deficiecy; reducing physiological disorders; improving shelf life of harvested crop PLANT IMPACT PLC (GB) 2010-06-22 US disclosed
US-20080307845-A1 A water-soluble salt of calcium (nitrate, sulfate, chloride) and anauxin mimetic, N,N'-diphenyurea; fertilizers; increasing cellular integrity by preventing areas of local calcium deficiecy; reducing physiological disorders; improving shelf life of harvested crop PLANT IMPACT PLC (GB) 2008-12-18 US disclosed
CN-101243026-A Agricultural composition PLANT IMPACT PLC (GB) 2008-08-13 CN disclosed
EP-1899283-A2 AGRICULTURAL COMPOSITION Plant Impact PLC (GB) 2008-03-19 EP disclosed
WO-2006134361-A2 AGRICULTURAL COMPOSITION PLANT IMPACT PLC (GB) 2006-12-21 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-11629105-B2 Plant treatment composition ALB, UGP2, TTR NPSR1 4412/4885HTT 504/4885PTGIR 2857/4885

“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.