SCHEMBL16796191

SCHEMBL16796191

N#Cc1cccc2c1cc(C=O)n2S(=O)(=O)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 1/20 0.43
▸ SRC P12931 2/20 0.40
▸ HTR6 P50406 11/20 0.40
▸ PPME1 Q9Y570 2/20 0.39
▸ MAOA P21397 1/20 0.37
▸ IMPDH2 P12268 1/20 0.36
▸ CXCL8 P10145 1/20 0.36
▸ NOD1 Q9Y239 1/20 0.36
▸ APEH P13798 1/20 0.36

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
SCHEMBL16796377 0.85 CNR2 (0.40) CNR2SRCHTR6PPME1IMPDH2
SCHEMBL16796376 0.85 CNR2 (0.40) CNR2SRCHTR6PPME1IMPDH2
SCHEMBL19771695 0.82 HTR6 (0.40) CNR2HTR6
SCHEMBL30229368 0.81 SRC (0.42) SRCHTR6CXCL8NOD1
SCHEMBL20839545 0.81 SRC (0.42) SRCHTR6CXCL8NOD1
SCHEMBL19771696 0.79 HTR6 (0.47) CNR2SRCHTR6IMPDH2
SCHEMBL25422879 0.78 MTNR1B (0.55) SRCHTR6
SCHEMBL369194 0.76 CA12 (0.52) SRCHTR6CXCL8NOD1
SCHEMBL30276218 0.76 CA12 (0.52) SRCHTR6CXCL8NOD1
SCHEMBL31487098 0.75 GAA (0.47) HTR6CXCL8NOD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9868722-B2 Monocyclic pyrimidine/pyridine compounds as inhibitors of P97 complex CLEAVE BIOSCIENCES, INC. (US) 2018-01-16 — — US disclosed
US-9868722-B2 Monocyclic pyrimidine/pyridine compounds as inhibitors of P97 complex CLEAVE BIOSCIENCES, INC. (US) 2018-01-16 — — US disclosed
US-20160304495-A1 MONOCYCLIC PYRIMIDINE/PYRIDINE COMPOUNDS AS INHIBITORS OF P97 COMPLEX CLEAVE BIOSCIENCES, INC. (US) 2016-10-20 — — US disclosed
US-20160304495-A1 MONOCYCLIC PYRIMIDINE/PYRIDINE COMPOUNDS AS INHIBITORS OF P97 COMPLEX CLEAVE BIOSCIENCES, INC. (US) 2016-10-20 — — US disclosed
US-20160304495-A1 MONOCYCLIC PYRIMIDINE/PYRIDINE COMPOUNDS AS INHIBITORS OF P97 COMPLEX CLEAVE BIOSCIENCES, INC. (US) 2016-10-20 — — US disclosed
EP-3080101-A1 MONOCYCLIC PYRIMIDINE/PYRIDINE COMPOUNDS AS INHIBITORS OF P97 COMPLEX Cleave Biosciences, Inc. (US) 2016-10-19 — — EP disclosed
WO-2015089218-A1 MONOCYCLIC PYRIMIDINE/PYRIDINE COMPOUNDS AS INHIBITORS OF P97 COMPLEX WUSTROW DAVID (US) 2015-06-18 — — WO disclosed
WO-2015089218-A1 MONOCYCLIC PYRIMIDINE/PYRIDINE COMPOUNDS AS INHIBITORS OF P97 COMPLEX WUSTROW DAVID (US) 2015-06-18 — — 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-20160304495-A1 MONOCYCLIC PYRIMIDINE/PYRIDINE COMPOUNDS AS INHIBITORS OF P97 COMPLEX PSMG3, PSMD2, PSME1 CNR2 4363/4885SRC 2977/4885HTR6 3730/4885

“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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