SCHEMBL10312134

SCHEMBL10312134

C/C=C/c1cc(Nc2nc(/C=C/c3cccc(C)c3)nc(NCC(O)CN3CCOCC3)n2)n[nH]1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
GBA1 P04062 1/20 0.36
MEN1 O00255 1/20 0.34
AURKA O14965 5/20 0.34
MAPT P10636 4/20 0.33
TP53 P04637 1/20 0.33
POLB P06746 1/20 0.33
AURKB Q96GD4 3/20 0.33
TSHR P16473 2/20 0.33
HSD17B10 Q99714 1/20 0.33
GRK6 P43250 1/20 0.33
ABCB1 P08183 2/20 0.32
IGF1R P08069 2/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
PLK4 O00444 2/20 0.32
ABL1 P00519 2/20 0.32
NTRK1 P04629 2/20 0.32

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
SCHEMBL10312200 0.92 GRK6 (0.35) L3MBTL1AURKAMAPTAURKBGRK6
SCHEMBL10312090 0.90 IDH2 (0.39) AURKAMAPTGRK6JAK3BTK
SCHEMBL10312155 0.88 IGF1R (0.43) IGF1RNTRK1
SCHEMBL10312188 0.84 JAK2 (0.41) AURKAAURKBPLK4ABL1NTRK1
SCHEMBL10312193 0.84 AURKA (0.41) AURKAAURKBTSHRIGF1RPLK4
SCHEMBL10312072 0.82 IDH2 (0.41) AURKAMAPTAURKBIGF1RPLK4
SCHEMBL16556839 0.82 GRK6 (0.33) AURKAMAPTGRK6IGF1RPLK4
SCHEMBL10312093 0.79 IGF1R (0.43) IGF1RPLK4NTRK1CDK7NTRK3
SCHEMBL16556861 0.78 IGF1R (0.42) IGF1RPLK4NTRK1
SCHEMBL10312199 0.77 FLT3 (0.45) KMT2AMEN1AURKAPOLBGRK6

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 KMT2A 1102/4885L3MBTL1 1508/4885GBA1 1985/4885

“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.