SCHEMBL22116403

SCHEMBL22116403

Cc1ccc(C2CC2)c(OC2(C(=O)O)CC2)c1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ PTGDR2 Q9Y5Y4 1/20 0.42
▸ SLC6A2 P23975 3/20 0.39
▸ SLC6A4 P31645 3/20 0.39
▸ SLC6A3 Q01959 3/20 0.39
▸ HTT P42858 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ DRD4 P21917 2/20 0.36
▸ KDM4C Q9H3R0 1/20 0.36
▸ HTR1A P08908 1/20 0.35
▸ PPARD Q03181 3/20 0.35
▸ SLC22A12 Q96S37 1/20 0.34
▸ DRD2 P14416 1/20 0.34
▸ PPARA Q07869 1/20 0.34
▸ LMNA P02545 3/20 0.33
▸ HPGD P15428 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ IDO1 P14902 1/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ MEN1 O00255 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
SCHEMBL22116308 0.95 PTGDR2 (0.39) PTGDR2SLC6A2SLC6A4SLC6A3HTT
SCHEMBL22116306 0.95 PTGDR2 (0.39) PTGDR2SLC6A2SLC6A4SLC6A3HTT
SCHEMBL22116357 0.94 PTGDR2 (0.49) PTGDR2SLC6A2SLC6A4SLC6A3LMNA
SCHEMBL22116359 0.94 PTGDR2 (0.38) PTGDR2SLC6A2SLC6A4SLC6A3HTT
SCHEMBL22116418 0.94 PTGDR2 (0.38) PTGDR2SLC6A2SLC6A4SLC6A3HTT
SCHEMBL22116360 0.94 PTGDR2 (0.38) PTGDR2SLC6A2SLC6A4SLC6A3HTT
SCHEMBL24234234 0.93 PTGDR2 (0.51) PTGDR2SLC6A2SLC6A4SLC6A3LMNA
SCHEMBL22116373 0.93 PTGDR2 (0.51) PTGDR2SLC6A2SLC6A4SLC6A3LMNA
SCHEMBL22116338 0.91 PTGDR2 (0.38) PTGDR2SLC6A2SLC6A4SLC6A3HTT
SCHEMBL22116415 0.91 PTGDR2 (0.41) PTGDR2SLC6A2SLC6A4SLC6A3HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3897832-B1 N-(PYRIDIN-2-YLSULFONYL)CYCLOPROPANECARBOXAMIDE DERIVATIVES AND THEIR USE IN THE TREATMENT OF A CFTR MEDIATED DISEASE NOVARTIS AG (CH) 2023-10-11 — — EP disclosed
US-20220033407-A1 N-(pyridin-2-ylsulfonyl)cyclopropanecarboxamide Derivatives and their Use in the Treatment of Disease NOVARTIS INSTITUTE FOR FUNCTIONAL GENOMICS, INC. 2022-02-03 — — US disclosed
EP-3897832-A1 N-(PYRIDIN-2-YLSULFONYL)CYCLOPROPANECARBOXAMIDE DERIVATIVES AND THEIR USE IN THE TREATMENT OF A CFTR MEDIATED DISEASE Novartis AG (CH) 2021-10-27 — — EP disclosed
CN-113226464-A N- (pyridin-2-ylsulfonyl) cyclopropanecarboxamide derivatives and their use in the treatment of CFTR mediated diseases 诺华股份有限公司 2021-08-06 — — CN disclosed
WO-2020128768-A1 N-(PYRIDIN-2-YLSULFONYL)CYCLOPROPANECARBOXAMIDE DERIVATIVES AND THEIR USE IN THE TREATMENT OF A CFTR MEDIATED DISEASE NOVARTIS AG (CH) 2020-06-25 — — 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-20220033407-A1 N-(pyridin-2-ylsulfonyl)cyclopropanecarboxamide Derivatives and their Use in the Treatment of Disease CFTR, PKD2, PKD1 PTGDR2 192/4885SLC6A2 2535/4885SLC6A4 1941/4885

“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.

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