SCHEMBL10312097

SCHEMBL10312097

CC(Nc1nc(/C=C/c2cccc(F)c2)nc(Nc2cc(C3CC3)[nH]n2)n1)c1ccncc1

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 14/20 0.53
JAK2 O60674 2/20 0.46
JAK3 P52333 1/20 0.46
IGF1R P08069 3/20 0.46
PAK3 O75914 2/20 0.40
PAK1 Q13153 2/20 0.40
PAK2 Q13177 2/20 0.40

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
SCHEMBL10312132 0.90 NTRK1 (0.47) NTRK1JAK2JAK3IGF1RPAK3
SCHEMBL10312185 0.90 NTRK1 (0.47) NTRK1JAK2JAK3IGF1RPAK3
SCHEMBL10312218 0.87 NTRK1 (0.44) NTRK1JAK2JAK3PAK1
SCHEMBL10312102 0.86 GRK6 (0.39) NTRK1JAK2JAK3
SCHEMBL10312211 0.85 IGF1R (0.50) NTRK1JAK2IGF1R
SCHEMBL10312083 0.81 IGF1R (0.43) NTRK1JAK2IGF1R
SCHEMBL10312082 0.80 HRH4 (0.44) IGF1RPAK1
SCHEMBL10312212 0.79 IGF1R (0.54) NTRK1JAK2IGF1R
SCHEMBL10312087 0.78 IGF1R (0.43) IGF1R
SCHEMBL10312197 0.77 NTRK1 (0.42) NTRK1JAK2JAK3IGF1RPAK1

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-20120178758-A1 STYRYL-TRIAZINE DERIVATIVES AND THEIR THERAPEUTICAL APPLICATIONS CALIFORNIA CAPITAL EQUITY, LLC (US) 2012-07-12 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-20120178758-A1 STYRYL-TRIAZINE DERIVATIVES AND THEIR THERAPEUTICAL APPLICATIONS STK25, STK35, SGK2 NTRK1 482/4885JAK2 176/4885JAK3 560/4885

“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.