SCHEMBL2531785

SCHEMBL2531785

CC(C)(C)OC(=O)N1CCN(Cc2ccc(-c3cc4nccc(Oc5ccc(NC(=O)NC6CC6)cc5F)c4s3)nc2)CC1

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MST1R Q04912 19/20 0.56
▸ NTRK1 P04629 1/20 0.51
▸ MET P08581 1/20 0.51
▸ KIT P10721 1/20 0.51
▸ AXL P30530 1/20 0.51
▸ KDR P35968 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
SCHEMBL14851260 0.92 MST1R (0.59) MST1RMETKDR
SCHEMBL14871673 0.92 MST1R (0.57) MST1RNTRK1METKITAXL
SCHEMBL12254509 0.92 MST1R (0.56) MST1RNTRK1METKITAXL
SCHEMBL2534630 0.92 MST1R (0.58) MST1RNTRK1METKITAXL
SCHEMBL12252123 0.91 MST1R (0.57) MST1RNTRK1METKITAXL
SCHEMBL14871772 0.91 MST1R (0.54) MST1RNTRK1METKITAXL
SCHEMBL2536093 0.91 MST1R (0.50) MST1RNTRK1METKITAXL
SCHEMBL14871592 0.91 MST1R (0.54) MST1RNTRK1METKITAXL
SCHEMBL12252333 0.91 MET (0.54) MST1RNTRK1METKITAXL
SCHEMBL12251145 0.91 MST1R (0.58) MST1R

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 13 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
US-8455484-B2 Selected inhibitors of protein tyrosine kinase activity METHYLGENE INC. (CA) 2013-06-04 — — US disclosed
US-8455484-B2 Selected inhibitors of protein tyrosine kinase activity METHYLGENE INC. (CA) 2013-06-04 — — US disclosed
US-20130096088-A1 Inhibitors of Protein Tyrosine Kinase Activity METHYLGENE INC. (CA) 2013-04-18 — — US disclosed
US-20130096135-A1 Selected Inhibitors of Protein Tyrosine Kinase Activity METHYLGENE INC. (CA) 2013-04-18 — — US 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
US-20110257100-A1 Inhibitors of Protein Tyrosine Kinase Activity METHYLGENE INC. (CA) 2011-10-20 — — US disclosed
US-20110257175-A1 Selected Inhibitors of Protein Tyrosine Kinase Activity METHYLGENE INC. (CA) 2011-10-20 — — US disclosed
US-20110257175-A1 Selected 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 (5 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 150/4885NTRK1 170/4885MET 138/4885
US-20130096088-A1 Inhibitors of Protein Tyrosine Kinase Activity KDR, FLT1, FLT4 MST1R 42/4885NTRK1 18/4885MET 25/4885
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 105/4885NTRK1 129/4885MET 49/4885
US-20130096135-A1 Selected Inhibitors of Protein Tyrosine Kinase Activity KDR, FLT1, FLT4 MST1R 49/4885NTRK1 11/4885MET 24/4885
US-20110257175-A1 Selected Inhibitors of Protein Tyrosine Kinase Activity ABL1, PRKDC, PRKACA MST1R 586/4885NTRK1 444/4885MET 669/4885

“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.

Send feedback