SCHEMBL10312084

SCHEMBL10312084

Fc1cccc(/C=C/c2nc(NCCCN3CCOCC3)nc(Nc3cc(C4CC4)[nH]n3)n2)c1

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 1/20 0.46
IGF1R P08069 12/20 0.46
FLT3 P36888 3/20 0.44
PLK4 O00444 1/20 0.43
POLB P06746 1/20 0.42
GSK3A P49840 1/20 0.42
GSK3B P49841 1/20 0.42
GRK6 P43250 1/20 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
SCHEMBL16556851 0.91 IGF1R (0.46) NTRK1IGF1RFLT3GSK3AGSK3B
SCHEMBL16556920 0.91 IGF1R (0.46) NTRK1IGF1RFLT3
SCHEMBL10312150 0.91 IGF1R (0.48) NTRK1IGF1RFLT3
SCHEMBL10312190 0.90 MELK (0.44) NTRK1IGF1RFLT3
SCHEMBL10312201 0.88 FLT3 (0.46) NTRK1IGF1RFLT3PLK4POLB
SCHEMBL10312199 0.87 FLT3 (0.45) FLT3POLBGSK3AGSK3BGRK6
SCHEMBL10312093 0.86 IGF1R (0.43) NTRK1IGF1RPLK4
SCHEMBL10312157 0.83 IGF1R (0.47) IGF1RPLK4
SCHEMBL10312211 0.80 IGF1R (0.50) NTRK1IGF1RPLK4GSK3B
SCHEMBL10312118 0.79 FLT3 (0.46) NTRK1IGF1RFLT3PLK4GSK3A

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 482/4885IGF1R 1148/4885FLT3 152/4885

“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.