SCHEMBL1679131

SCHEMBL1679131

CN(C)CCCNC(=O)c1cccc(-c2cncc(-c3ccc(O)cc3)n2)c1

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FYN P06241 9/20 0.80
PIM2 Q9P1W9 1/20 0.49
METAP2 P50579 1/20 0.49
KDR P35968 1/20 0.48
CAMK2D Q13557 1/20 0.48
KDM4E B2RXH2 2/20 0.48
TET3 O43151 1/20 0.48
TET2 Q6N021 1/20 0.48
TET1 Q8NFU7 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
CHUK O15111 1/20 0.48
INSR P06213 1/20 0.48
MAPK8 P45983 1/20 0.48
CAMKK2 Q96RR4 1/20 0.48
CHEK1 O14757 1/20 0.47
MAP4K4 O95819 1/20 0.47
NPC1 O15118 1/20 0.47
ALDH1A1 P00352 1/20 0.47
POLB P06746 1/20 0.47
MAPT P10636 1/20 0.47

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
SCHEMBL18613235 0.89 FYN (1.00) FYNPIM2KDM4EL3MBTL1CHEK1
SCHEMBL2927120 0.87 FYN (0.62) FYNPIM2KDRKDM4ETET3
SCHEMBL1679471 0.85 FYN (0.87) FYNPIM2KDRL3MBTL1MAPT
SCHEMBL1679000 0.85 FYN (0.69) FYNKDRSRC
SCHEMBL1679230 0.83 FYN (0.67) FYNKDRCAMK2DMAP4K4
SCHEMBL8486450 0.82 FYN (0.66) FYNMETAP2CAMK2DKDM4ETET3
Hydrochloric Acid SCHEMBL8582820 0.81 FYN (0.65) FYNMETAP2CAMK2DKDM4ETET3
SCHEMBL2933512 0.81 KDR (0.68) FYNKDRCAMK2DSRC
SCHEMBL1679113 0.80 FYN (0.68) FYNKDRCAMK2DMAPK8CHEK1
SCHEMBL13515278 0.79 FYN (0.59) FYNKDRKDM4EMAPK8CHEK1

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 9 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
EP-2114887-A1 PYRIDINE BENZAMIDES AND PYRAZINE BENZAMIDES USED AS PKD INHIBITORS Cancer Research Technology Limited (GB) 2009-11-11 EP claimed
WO-2008074997-A1 PYRIDINE BENZAMIDES AND PYRAZINE BENZAMIDES USED AS PKD INHIBITORS CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2008-06-26 WO 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
EP-2114887-A1 PYRIDINE BENZAMIDES AND PYRAZINE BENZAMIDES USED AS PKD INHIBITORS Cancer Research Technology Limited (GB) 2009-11-11 EP disclosed
WO-2008074997-A1 PYRIDINE BENZAMIDES AND PYRAZINE BENZAMIDES USED AS PKD INHIBITORS CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2008-06-26 WO 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 1665/4885PIM2 135/4885METAP2 2936/4885

“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.