SCHEMBL22972979

SCHEMBL22972979

[2H]C([2H])([2H])Nc1nc(-c2cc(C(=O)N3CCN(Cc4ccc(Cl)cc4)CC3)c(Cl)cn2)cs1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
WNK1 Q9H4A3 5/20 1.00
LSS P48449 2/20 0.41
SLC12A2 P55011 1/20 0.41
STAT3 P40763 2/20 0.40
PTGS2 P35354 1/20 0.40
AURKA O14965 1/20 0.40
GPR183 P32249 1/20 0.39
POLB P06746 1/20 0.39
HTT P42858 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
TP53 P04637 1/20 0.39
CHRNA7 P36544 1/20 0.39
MAPT P10636 1/20 0.38

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
SCHEMBL29719211 1.00 WNK1 (1.00) WNK1LSSSLC12A2STAT3PTGS2
Hydrochloric Acid SCHEMBL29719312 0.99 WNK1 (0.98) WNK1LSSSLC12A2STAT3PTGS2
Hydrochloric Acid SCHEMBL22972975 0.99 WNK1 (0.98) WNK1LSSSLC12A2STAT3PTGS2
SCHEMBL22972978 0.94 WNK1 (1.00) WNK1LSSSLC12A2STAT3PTGS2
SCHEMBL30423029 0.94 WNK1 (1.00) WNK1LSSSLC12A2STAT3PTGS2
SCHEMBL22972977 0.84 WNK1 (0.72) WNK1LSSSTAT3PTGS2GPR183
SCHEMBL29719250 0.78 WNK1 (0.64) WNK1LSSSTAT3PTGS2POLB
SCHEMBL22972976 0.75 WNK1 (0.62) WNK1LSSPTGS2GPR183POLB
SCHEMBL29719297 0.75 WNK1 (0.62) WNK1LSSPTGS2GPR183POLB
SCHEMBL22972973 0.71 WNK1 (0.57) WNK1LSSPTGS2GPR183TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12458637-B2 Targeting WNK1 in blood cancers Københavns Universitet (DK) 2025-11-04 US claimed
US-12458637-B2 Targeting WNK1 in blood cancers Københavns Universitet (DK) 2025-11-04 US disclosed
EP-4013413-B1 TARGETING WNK1 IN BLOOD CANCERS UNIV COPENHAGEN (DK) 2025-01-29 EP disclosed
US-20220288063-A1 TARGETING WNK1 IN BLOOD CANCERS Københavns Universitet (DK) 2022-09-15 US disclosed
EP-4013413-A1 TARGETING WNK1 IN BLOOD CANCERS Københavns Universitet (DK) 2022-06-22 EP disclosed
WO-2021028438-A1 TARGETING WNK1 IN BLOOD CANCERS Københavns Universitet (DK) 2021-02-18 WO disclosed
EP-3777857-A1 TARGETING WNK1 IN BLOOD CANCERS Københavns Universitet (DK) 2021-02-17 EP 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-20220288063-A1 TARGETING WNK1 IN BLOOD CANCERS WNK1, WNK2, TTK WNK1 1/4885LSS 4376/4885SLC12A2 2391/4885
US-12458637-B2 Targeting WNK1 in blood cancers WNK1, WNK2, TTK WNK1 1/4885LSS 4376/4885SLC12A2 2391/4885

“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.