SCHEMBL3016002

SCHEMBL3016002

CNc1cc(-n2ncnc2Nc2cc(NC(=O)c3ccnc(C(C)(C)C)c3)ccc2C)ncn1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.48
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
MAPK14 Q16539 3/20 0.46
BRAF P15056 5/20 0.44
RAF1 P04049 4/20 0.44
ALDH1A1 P00352 1/20 0.43
LCK P06239 8/20 0.43
LYN P07948 8/20 0.43
SRC P12931 8/20 0.43
KDR P35968 8/20 0.43
HCK P08631 7/20 0.43
INSR P06213 6/20 0.43
TEK Q02763 1/20 0.42

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
SCHEMBL3020220 0.94 MAPK14 (0.47) LMNANPC1RAB9ASMN1; SMN2MAPK14
SCHEMBL3020597 0.94 BRAF (0.46) MAPK14BRAFRAF1LCKLYN
SCHEMBL3017957 0.93 BRAF (0.47) LMNANPC1RAB9ASMN1; SMN2MAPK14
SCHEMBL3591361 0.89 LMNA (0.48) LMNANPC1RAB9ASMN1; SMN2MAPK14
SCHEMBL3016256 0.88 MAPK14 (0.52) LMNANPC1RAB9ASMN1; SMN2MAPK14
SCHEMBL3594934 0.87 LMNA (0.48) LMNANPC1RAB9ASMN1; SMN2MAPK14
SCHEMBL3015708 0.86 LCK (0.51) BRAFLCKLYNSRCKDR
SCHEMBL3022247 0.85 LCK (0.53) BRAFLCKLYNSRCKDR
SCHEMBL3590926 0.85 LMNA (0.46) LMNANPC1RAB9ASMN1; SMN2MAPK14
SCHEMBL3020035 0.85 LCK (0.59) BRAFLCKLYNSRCKDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100184765-A1 Protein Kinase Inhibitors and Methods for Using Thereof IRM LLC 2010-07-22 US claimed
EP-2170867-A1 PROTEIN KINASE INHIBITORS AND METHODS FOR USING THEREOF IRM LLC (BM) 2010-04-07 EP claimed
WO-2008157131-A1 PROTEIN KINASE INHIBITORS AND METHODS FOR USING THEREOF IRM LLC (BM) 2008-12-24 WO claimed
US-20100184765-A1 Protein Kinase Inhibitors and Methods for Using Thereof IRM LLC 2010-07-22 US disclosed
US-20100184765-A1 Protein Kinase Inhibitors and Methods for Using Thereof IRM LLC 2010-07-22 US disclosed
US-20100184765-A1 Protein Kinase Inhibitors and Methods for Using Thereof IRM LLC 2010-07-22 US disclosed
EP-2170867-A1 PROTEIN KINASE INHIBITORS AND METHODS FOR USING THEREOF IRM LLC (BM) 2010-04-07 EP disclosed
WO-2008157131-A1 PROTEIN KINASE INHIBITORS AND METHODS FOR USING THEREOF IRM LLC (BM) 2008-12-24 WO 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-20100184765-A1 Protein Kinase Inhibitors and Methods for Using Thereof BMX, FRK, FYN LMNA 3218/4885NPC1 3503/4885RAB9A 2293/4885

“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.