SCHEMBL9379558

SCHEMBL9379558

Cc1ccc(CC#N)c(OCc2ccccc2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 2/20 0.47
▸ CYP1A2 P05177 2/20 0.47
▸ CYP2C9 P11712 2/20 0.47
▸ ATP4A P20648 2/20 0.47
▸ ATP4B P51164 2/20 0.47
▸ MEN1 O00255 1/20 0.47
▸ CYP3A4 P08684 1/20 0.47
▸ CYP2D6 P10635 1/20 0.47
▸ BLM P54132 1/20 0.47
▸ PMP22 Q01453 1/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ HDAC6 Q9UBN7 1/20 0.47
▸ MAPT P10636 1/20 0.46
▸ TDP1 Q9NUW8 1/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ SGMS2 Q8NHU3 2/20 0.45
▸ ALDH1A1 P00352 2/20 0.45
▸ LMNA P02545 2/20 0.45
▸ CYP2C19 P33261 1/20 0.45
▸ PTGER1 P34995 2/20 0.44

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
SCHEMBL3819411 0.84 MAOB (0.55) CYP1A2HDAC6MAPTL3MBTL1LMNA
SCHEMBL6035647 0.83 MAOB (0.51) TDP1SGMS2ALDH1A1LMNAMAOB
SCHEMBL28104163 0.82 FFAR1 (0.45) MAPK1CYP1A2CYP2C9ATP4AATP4B
SCHEMBL11611970 0.81 MAPT (0.51) MAPK1CYP3A4CYP2D6MAPTTDP1
SCHEMBL19101161 0.81 L3MBTL1 (0.51) MAPK1MAPTTDP1L3MBTL1PTGER1
SCHEMBL3150720 0.81 HTR1A (0.61) MAPK1CYP1A2CYP2C9ATP4AATP4B
SCHEMBL9376228 0.80 PTGER1 (0.50) MAPK1MAPTTDP1L3MBTL1PTGER1
SCHEMBL15831986 0.80 MAPT (0.50) MAPK1MAPTTDP1L3MBTL1PTGER1
SCHEMBL9381880 0.80 MAPT (0.50) MAPK1CYP1A2CYP2C9MAPTTDP1
SCHEMBL14228414 0.79 MAPT (0.56) MAPK1CYP2C9MAPTTDP1L3MBTL1

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-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
EP-0278176-B1 Compounds having antitumour and antibacterial properties WARNER LAMBERT CO (US) 1994-03-09 — — EP disclosed
US-5281620-A Alkyl substituted xanthenone-4-acetic acid CANCER RESEARCH CAMPAIGN TECHNOLOGY LIMITED (GB) 1994-01-25 — — US disclosed
EP-0278176-A2 Compounds having antitumour and antibacterial properties WARNER-LAMBERT COMPANY (US) 1988-08-17 — — 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 (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 MAPK1 4000/4885CYP1A2 646/4885CYP2C9 1085/4885

“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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