SCHEMBL7611213

SCHEMBL7611213

Cn1nc(-c2ccccc2)cc1N/C=C1\C(=O)Nc2cccnc21

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.45
NTRK1 P04629 3/20 0.45
NTRK3 Q16288 2/20 0.45
NTRK2 Q16620 2/20 0.45
KDR P35968 2/20 0.45
GSK3B P49841 2/20 0.45
CDK5 Q00535 2/20 0.45
HDAC6 Q9UBN7 1/20 0.45
MEN1 O00255 1/20 0.45
AURKA O14965 1/20 0.45
ROCK2 O75116 1/20 0.45
PRKD3 O94806 1/20 0.45
MAP4K4 O95819 1/20 0.45
CHEK2 O96017 1/20 0.45
INSR P06213 1/20 0.45
LCK P06239 1/20 0.45
CDK1 P06493 1/20 0.45
LYN P07948 1/20 0.45
RET P07949 1/20 0.45
IGF1R P08069 1/20 0.45

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
SCHEMBL7611215 1.00 MAPT (0.45) MAPTNTRK1NTRK3NTRK2KDR
SCHEMBL7723563 0.85 RAF1 (0.43) MAPTNTRK1POLBRAB9AXBP1
SCHEMBL5462483 0.81 MAOA (0.45) MAPTNTRK1NTRK3NTRK2KDR
SCHEMBL5462488 0.81 MAOA (0.45) MAPTNTRK1NTRK3NTRK2KDR
SCHEMBL7606283 0.78 JAK3 (0.41) MAPTNTRK1NTRK3NTRK2KDR
SCHEMBL7606291 0.78 JAK3 (0.41) MAPTNTRK1NTRK3NTRK2KDR
SCHEMBL7609675 0.76 NTRK1 (0.46) MAPTNTRK1NTRK3NTRK2KDR
SCHEMBL7609671 0.76 NTRK1 (0.46) MAPTNTRK1NTRK3NTRK2KDR
SCHEMBL7606270 0.75 MAPT (0.40) MAPTNTRK1MEN1KMT2APOLB
SCHEMBL5421094 0.75 RET (0.40) MAPTMEN1RETCDK2RPS6KA3

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-20020099071-A1 Protein tyrosine kinase and protein serin/threonine kinase inhibitory activity; anticancer agents; treating chemotherapy induced alopecia GLENNON KIMBERLEY CAROLINE (US) 2002-07-25 US claimed

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-20020099071-A1 Protein tyrosine kinase and protein serin/threonine kinase inhibitory activity; anticancer agents; treating chemotherapy induced alopecia PRKDC, PRKX, BMX MAPT 2317/4885NTRK1 1095/4885NTRK3 543/4885

“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.