SCHEMBL21144313

SCHEMBL21144313

O=S(=O)(Cl)c1cccnc1OC(F)F

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV4 Q9HBA0 2/20 1.00
NR3C1 P04150 1/20 0.37
PGR P06401 1/20 0.37
NFE2L2 Q16236 10/20 0.37
SLC22A12 Q96S37 1/20 0.35
GRM4 Q14833 1/20 0.34
RXRA P19793 2/20 0.34
GRIN1 Q05586 2/20 0.34
GRIN2B Q13224 2/20 0.34
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
MAPK1 P28482 1/20 0.33
CA9 Q16790 1/20 0.33
NPC1 O15118 1/20 0.32
MAPT P10636 1/20 0.32
NFKB1 P19838 1/20 0.32
RAB9A P51151 1/20 0.32
NFKB2 Q00653 1/20 0.32
RELA Q04206 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
Hydrochloric Acid SCHEMBL28293552 0.82 TRPV4 (0.69) TRPV4NR3C1PGRNFE2L2SLC22A12
SCHEMBL31399726 0.80 TRPV4 (0.67) TRPV4NR3C1PGRGRM4
SCHEMBL30504923 0.77 TRPV4 (0.63) TRPV4NFE2L2SLC22A12CA1CA2
SCHEMBL7867107 0.77 TRPV4 (0.63) TRPV4NFE2L2SLC22A12CA1CA2
SCHEMBL2646025 0.73 TRPV4 (0.57) TRPV4NR3C1PGRGRM4RXRA
SCHEMBL31348081 0.73 TRPV4 (0.57) TRPV4NFE2L2GRM4RXRAGRIN1
SCHEMBL363458 0.73 TRPV4 (0.57) TRPV4NFE2L2GRM4RXRAGRIN1
SCHEMBL21046774 0.72 TRPV4 (0.56) TRPV4SLC22A12RXRAGRIN1GRIN2B
SCHEMBL30989845 0.72 TRPV4 (0.56) TRPV4SLC22A12
SCHEMBL1610883 0.72 TRPV4 (0.56) TRPV4SLC22A12CA1CA2CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023159322-A1 QUINAZOLINE DERIVATIVES AS INHIBITORS OF THE GCN2 KINASE, COMPOSITIONS AND USES THEREOF ONTARIO INSTITUTE FOR CANCER RESEARCH (OICR) (CA) 2023-08-31 WO disclosed
US-11260049-B2 TRPV4 antagonists GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO. 2) LIMITED (GB) 2022-03-01 US disclosed
US-11229623-B2 TRPV4 antagonists GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO. 2) LIMITED (GB) 2022-01-25 US disclosed
US-11229623-B2 TRPV4 antagonists GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO. 2) LIMITED (GB) 2022-01-25 US disclosed
US-20210299113-A1 TRPV4 ANTAGONISTS GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2021-09-30 US disclosed
US-20210299113-A1 TRPV4 ANTAGONISTS GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2021-09-30 US disclosed
EP-3515887-B1 TRPV4 ANTAGONISTS GLAXOSMITHKLINE IP NO 2 LTD (GB) 2021-07-07 EP disclosed
EP-3515888-B1 TRPV4 ANTAGONISTS GLAXOSMITHKLINE IP NO 2 LTD (GB) 2021-03-31 EP disclosed
US-20200261411-A1 TRPV4 ANTAGONISTS GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2020-08-20 US disclosed
US-10588891-B2 TRPV4 antagonists GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2020-03-17 US disclosed
US-20190216774-A1 TRPV4 ANTAGONISTS GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2019-07-18 US disclosed
US-20190216774-A1 TRPV4 ANTAGONISTS GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2019-07-18 US 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 (6 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-11260049-B2 TRPV4 antagonists TRPV4, TRPV5, TRPV2 TRPV4 1/4885NR3C1 3622/4885PGR 2342/4885
US-20210299113-A1 TRPV4 ANTAGONISTS TRPV4, TRPV5, TRPV2 TRPV4 1/4885NR3C1 3622/4885PGR 2342/4885
US-10588891-B2 TRPV4 antagonists TRPV4, TRPV5, TRPV2 TRPV4 1/4885NR3C1 3622/4885PGR 2342/4885
US-11229623-B2 TRPV4 antagonists TRPV4, TRPV5, TRPV2 TRPV4 1/4885NR3C1 3622/4885PGR 2342/4885
US-20200261411-A1 TRPV4 ANTAGONISTS TRPV4, TRPV5, TRPV2 TRPV4 1/4885NR3C1 3622/4885PGR 2342/4885
US-20190216774-A1 TRPV4 ANTAGONISTS TRPV4, TRPV5, TRPV2 TRPV4 1/4885NR3C1 3622/4885PGR 2342/4885

“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.