SCHEMBL14169142

SCHEMBL14169142

N#Cc1cc(NC(=N)c2ccoc2)ccc1F

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GRM4 Q14833 1/20 0.43
BLM P54132 1/20 0.38
WRN Q14191 1/20 0.38
EGFR P00533 1/20 0.36
ABCG2 Q9UNQ0 1/20 0.36
KCNH2 Q12809 1/20 0.35
LRRK2 Q5S007 1/20 0.35
RAB9A P51151 1/20 0.35
AKT1 P31749 1/20 0.35
KCNK3 O14649 1/20 0.35
KCNK9 Q9NPC2 1/20 0.35
MAPK14 Q16539 2/20 0.33
CNR2 P34972 1/20 0.33
AR P10275 1/20 0.33
PGR P06401 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
SCHEMBL4728344 0.84 GRM4 (0.43) GRM4BLMWRNEGFRABCG2
SCHEMBL4728346 0.84 GRM4 (0.43) GRM4BLMWRNEGFRABCG2
SCHEMBL14259995 0.80 RAB9A (0.37) RAB9AKCNK3KCNK9MAPK14
SCHEMBL14259997 0.80 MEN1 (0.50) RAB9A
SCHEMBL14259992 0.76 ALDH1A1 (0.49) GRM4BLMWRNEGFRRAB9A
SCHEMBL14169176 0.76 MAPT (0.48) GRM4RAB9AKCNK3KCNK9
SCHEMBL14259993 0.74 GRM4 (0.49) GRM4BLMWRNEGFRABCG2
SCHEMBL12053079 0.71 GRM4 (0.44) GRM4BLMWRNAKT1
SCHEMBL4728348 0.70 IDO1 (0.48)
SCHEMBL4900667 0.69 GRM4 (0.59) GRM4BLMWRNABCG2KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080146624-A1 AMIDINES AS MODULATORS OF INDOLEAMINE 2,3-DIOXYGENASE INCYTE CORPORATION (US) 2008-06-19 US 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-20080146624-A1 AMIDINES AS MODULATORS OF INDOLEAMINE 2,3-DIOXYGENASE IDO1, IDO2, INMT GRM4 489/4885BLM 3769/4885WRN 2625/4885

“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.