SCHEMBL15907191

SCHEMBL15907191

C#Cc1cccc(C(=O)Nc2cncnc2OC)c1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.43
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
GRM5 P41594 8/20 0.42
GSK3A P49840 1/20 0.41
GSK3B P49841 1/20 0.41
RAB9A P51151 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
ALDH1A1 P00352 1/20 0.40
NPC1 O15118 1/20 0.40
POLB P06746 1/20 0.40
HTT P42858 1/20 0.40
DRD2 P14416 1/20 0.39
DRD4 P21917 1/20 0.39
DRD3 P35462 1/20 0.39
BRAF P15056 1/20 0.39

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
SCHEMBL15907175 0.83 PDE4A (0.39) EGFRGRM5GSK3AGSK3B
SCHEMBL15907192 0.81 KIT (0.44) EGFRKMT2AMEN1GSK3AGSK3B
SCHEMBL18323125 0.80 EGFR (0.44) EGFRKMT2AMEN1GSK3AGSK3B
SCHEMBL15907202 0.77 MEN1 (0.50) EGFRKMT2AMEN1RAB9AALDH1A1
SCHEMBL15907240 0.77 NPC1 (0.42) EGFRKMT2AMEN1GRM5RAB9A
SCHEMBL15907308 0.77 CSF1R (0.38) EGFRKMT2AMEN1GRM5SMN1; SMN2
SCHEMBL15907315 0.75 KIT (0.39) EGFRGRM5RAB9ASMN1; SMN2ALDH1A1
SCHEMBL15907282 0.75 CHEK1 (0.38) EGFRKMT2AMEN1RAB9AALDH1A1
SCHEMBL15907193 0.74 ATR (0.36) EGFRKMT2AMEN1GRM5GSK3A
SCHEMBL27731208 0.73 EGFR (0.65) EGFRSMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9522910-B2 Protein kinase inhibitors (variants), use thereof in treating oncological diseases and a pharmaceutical composition based thereon Obshchestvo s ogranichennoy otvetstvennostyou “Fusion Pharma” (RU) 2016-12-20 US disclosed
US-9522910-B2 Protein kinase inhibitors (variants), use thereof in treating oncological diseases and a pharmaceutical composition based thereon Obshchestvo s ogranichennoy otvetstvennostyou “Fusion Pharma” (RU) 2016-12-20 US disclosed
US-20140213592-A1 Protein Kinase Inhibitors (Variants), Use Thereof in Treating Oncological Diseases and a Pharmaceutical Composition Based Thereon OBSHCHESTVO S OGRANICHENNOY OTVETSTVENNOSTYOU "FUSION PHARMA" (RU) 2014-07-31 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-20140213592-A1 Protein Kinase Inhibitors (Variants), Use Thereof in Treating Oncological Diseases and a Pharmaceutical Composition Based Thereon ABL1, ABL2, MAP3K6 EGFR 334/4885KMT2A 1272/4885MEN1 1500/4885

“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.