SCHEMBL2579407

SCHEMBL2579407

O=C(Nc1ccc(Oc2ccnc3cc(-c4ccc(CN5CCNCC5=O)cn4)sc23)c(F)c1)NC1CC1

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MST1R Q04912 17/20 0.53
MET P08581 3/20 0.51
KDR P35968 3/20 0.51
NTRK1 P04629 1/20 0.51
KIT P10721 1/20 0.51
AXL P30530 1/20 0.51
FLT3 P36888 1/20 0.51
NTRK2 Q16620 1/20 0.51

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
SCHEMBL2539215 0.92 MST1R (0.55) MST1RMETKDRNTRK1KIT
SCHEMBL1478490 0.91 MST1R (0.54) MST1RMETKDRNTRK1KIT
SCHEMBL2534528 0.91 MET (0.59) MST1RMETKDRNTRK1KIT
SCHEMBL2579408 0.90 MET (0.44) MST1RMETKDRNTRK1KIT
SCHEMBL2538054 0.89 MST1R (0.57) MST1RMETKDRNTRK1KIT
SCHEMBL2533792 0.88 MST1R (0.56) MST1RMETKDR
SCHEMBL2533788 0.88 MET (0.57) MST1RMETKDR
SCHEMBL2534301 0.88 MST1R (0.54) MST1RMETKDRNTRK1KIT
SCHEMBL2534298 0.88 MST1R (0.54) MST1RMETKDRNTRK1KIT
SCHEMBL2537118 0.88 MST1R (0.54) MST1RMETKDRNTRK1KIT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8906852-B2 Inhibitors of protein tyrosine kinase activity METHYLGENE INC. (CA) 2014-12-09 US disclosed
US-8906852-B2 Inhibitors of protein tyrosine kinase activity METHYLGENE INC. (CA) 2014-12-09 US disclosed
US-20140315801-A1 METHODS OF TREATMENT OF CELL PROLIFERATIVE AND/OR OPHTHALMIC DISEASES, DISORDERS AND CONDITIONS USING INHIBITORS OF PROTEIN TYROSINE KINASE ACTIVITY METHYLGENE INC (CA) 2014-10-23 US disclosed
US-20140315801-A1 METHODS OF TREATMENT OF CELL PROLIFERATIVE AND/OR OPHTHALMIC DISEASES, DISORDERS AND CONDITIONS USING INHIBITORS OF PROTEIN TYROSINE KINASE ACTIVITY METHYLGENE INC (CA) 2014-10-23 US disclosed
EP-2563795-A1 INHIBITORS OF PROTEIN TYROSINE KINASE ACTIVITY MethylGene Inc. (CA) 2013-03-06 EP disclosed
WO-2011127567-A1 INHIBITORS OF PROTEIN TYROSINE KINASE ACTIVITY METHYLGENE INC. (CA) 2011-10-20 WO disclosed
US-20110257100-A1 Inhibitors of Protein Tyrosine Kinase Activity METHYLGENE INC. (CA) 2011-10-20 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 (2 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-20110257100-A1 Inhibitors of Protein Tyrosine Kinase Activity ERBB2, ABL1, FLT1 MST1R 150/4885MET 138/4885KDR 5/4885
US-20140315801-A1 METHODS OF TREATMENT OF CELL PROLIFERATIVE AND/OR OPHTHALMIC DISEASES, DISORDERS AND CONDITIONS USING INHIBITORS OF PROTEIN TYROSINE KINASE ACTIVITY FLT1, KDR, FLT4 MST1R 105/4885MET 49/4885KDR 2/4885

“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.