SCHEMBL22535692

SCHEMBL22535692

CC(Nc1ncnc(Nc2cc(C3CC3)[nH]n2)n1)c1c(F)cccc1F

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 9/20 0.56
JAK2 O60674 2/20 0.55
IGF1R P08069 6/20 0.52
PAK1 Q13153 4/20 0.51
PAK3 O75914 3/20 0.51
PAK2 Q13177 3/20 0.51
JAK3 P52333 1/20 0.46
NEK1 Q96PY6 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
SCHEMBL22535699 0.90 NTRK1 (0.52) NTRK1JAK2IGF1RPAK1PAK3
SCHEMBL22535848 0.88 NTRK1 (0.52) NTRK1JAK2IGF1RPAK1PAK3
SCHEMBL22535332 0.87 NTRK1 (0.51) NTRK1JAK2IGF1RPAK1PAK3
SCHEMBL22535282 0.85 NTRK1 (0.50) NTRK1JAK2IGF1RPAK1PAK3
SCHEMBL22535726 0.85 NTRK1 (0.49) NTRK1JAK2IGF1RPAK1PAK3
SCHEMBL22535690 0.85 NTRK1 (0.63) NTRK1JAK2IGF1RPAK1PAK3
SCHEMBL22535688 0.84 NTRK1 (0.76) NTRK1JAK2IGF1RJAK3
SCHEMBL22535736 0.84 NTRK1 (0.59) NTRK1JAK2IGF1RPAK1PAK3
SCHEMBL22535790 0.84 NTRK1 (0.59) NTRK1JAK2IGF1RPAK1PAK3
SCHEMBL22535693 0.84 NTRK1 (0.59) NTRK1JAK2IGF1RPAK1PAK3

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-10800760-B2 Trk inhibition NANTBIO, INC. (US) 2020-10-13 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-10800760-B2 Trk inhibition NTRK1, NTRK3, NTRK2 NTRK1 1/4885JAK2 833/4885IGF1R 249/4885

“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.