SCHEMBL1679707

SCHEMBL1679707

COc1cc(-c2cncc(-c3cccc(C(N)=O)c3)n2)ccc1O

nearest known ligand 0.63

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FYN P06241 5/20 0.63
CHEK1 O14757 2/20 0.51
ERN1 O75460 2/20 0.51
CHEK2 O96017 1/20 0.51
RAF1 P04049 2/20 0.50
BRAF P15056 2/20 0.50
CSF1R P07333 3/20 0.49
ATR Q13535 1/20 0.49
PARP1 P09874 1/20 0.49
MKNK1 Q9BUB5 3/20 0.48
MKNK2 Q9HBH9 3/20 0.48
ALOX5AP P20292 1/20 0.46

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
SCHEMBL1679065 0.89 FYN (0.64) FYNCHEK1ERN1CSF1R
SCHEMBL12734489 0.89 FYN (0.64) FYNCHEK1BRAFCSF1R
SCHEMBL1679204 0.88 FYN (0.63) FYNCHEK1ERN1BRAFCSF1R
SCHEMBL1679228 0.84 FYN (0.58) FYNCHEK1ERN1BRAFCSF1R
SCHEMBL1679100 0.82 FYN (0.57) FYNERN1BRAFCSF1R
SCHEMBL1679061 0.82 FYN (0.56) FYNERN1CSF1R
SCHEMBL1679545 0.80 FYN (0.53) FYNERN1CSF1RATRMKNK1
SCHEMBL1679573 0.80 KMT2A (0.59) FYNERN1ATR
SCHEMBL1679113 0.79 FYN (0.68) FYNCHEK1CSF1R
SCHEMBL1679092 0.78 FYN (0.80) FYNCHEK1CHEK2

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
US-20110098325-A1 PYRIDINE BENZAMIDES AND PYRAZINE BENZAMIDES USED AS PKD INHIBITORS CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2011-04-28 US claimed
US-20110098325-A1 PYRIDINE BENZAMIDES AND PYRAZINE BENZAMIDES USED AS PKD INHIBITORS CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2011-04-28 US disclosed
US-20110098325-A1 PYRIDINE BENZAMIDES AND PYRAZINE BENZAMIDES USED AS PKD INHIBITORS CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2011-04-28 US disclosed
US-20110098325-A1 PYRIDINE BENZAMIDES AND PYRAZINE BENZAMIDES USED AS PKD INHIBITORS CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2011-04-28 US disclosed
WO-2008074997-A1 PYRIDINE BENZAMIDES AND PYRAZINE BENZAMIDES USED AS PKD INHIBITORS CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2008-06-26 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-20110098325-A1 PYRIDINE BENZAMIDES AND PYRAZINE BENZAMIDES USED AS PKD INHIBITORS PKD2, PKD1, BAZ2B FYN 1665/4885CHEK1 805/4885ERN1 1840/4885

“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.