SCHEMBL20486254

SCHEMBL20486254

CN(c1ccc2ncc(-c3c[c]ccc3)n2n1)c1ccco1

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 1/20 0.41
NTRK3 Q16288 1/20 0.41
NTRK2 Q16620 1/20 0.41
FYN P06241 17/20 0.39
MKNK1 Q9BUB5 2/20 0.35

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
SCHEMBL2951022 0.83 DYRK3 (0.53) FYN
SCHEMBL4691714 0.82 FYN (0.39) NTRK1NTRK3NTRK2FYNMKNK1
SCHEMBL2946667 0.82 FYN (0.50) FYNMKNK1
SCHEMBL1053479 0.80 FYN (0.56) NTRK1NTRK3NTRK2FYN
SCHEMBL2948418 0.80 FYN (0.57) NTRK1NTRK3NTRK2FYN
SCHEMBL18613617 0.79 FYN (0.58) FYN
SCHEMBL2947614 0.79 FYN (0.54) FYN
SCHEMBL18613580 0.78 FYN (0.61) FYN
SCHEMBL2951390 0.78 FYN (0.54) NTRK1NTRK3NTRK2FYN
SCHEMBL2948461 0.76 FYN (0.53) FYN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10688093-B2 Methods, compositions, and uses of novel Fyn kinase inhibitors Pathways Neuro Pharma, Inc. 2020-06-23 US disclosed
US-20180250297-A1 Methods, Compositions, and Uses of Novel FYN Kinase Inhibitors Pathways Neuro Pharma, Inc. 2018-09-06 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 (2 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-20180250297-A1 Methods, Compositions, and Uses of Novel FYN Kinase Inhibitors FYN, LCK, PTK2B NTRK1 399/4885NTRK3 473/4885NTRK2 229/4885
US-10688093-B2 Methods, compositions, and uses of novel Fyn kinase inhibitors FYN, LCK, PTK2B NTRK1 399/4885NTRK3 473/4885NTRK2 229/4885

“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.