SCHEMBL691599

SCHEMBL691599

CCn1nccc1Nc1cc(Nc2ccc(N3CCN(CCO)CC3)cc2C(=O)NC)c(Cl)cn1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK10 P53779 8/20 0.50
MAPK9 P45984 7/20 0.50
ALK Q9UM73 4/20 0.42
MAPK1 P28482 2/20 0.42
MAPK3 P27361 1/20 0.42
INSR P06213 3/20 0.40
IGF1R P08069 3/20 0.40
PTK2 Q05397 4/20 0.39
FGFR1 P11362 3/20 0.38
PDGFRB P09619 2/20 0.38
FLT1 P17948 2/20 0.38
FGFR3 P22607 2/20 0.38
KDR P35968 2/20 0.38
PDGFRA P16234 1/20 0.38
FGFR2 P21802 1/20 0.38
PTK2B Q14289 2/20 0.38
CDC7 O00311 1/20 0.38
PLK4 O00444 1/20 0.38
CHEK1 O14757 1/20 0.38
AURKA O14965 1/20 0.38

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
SCHEMBL20312519 0.92 ALK (0.45) MAPK10MAPK9ALKINSRIGF1R
SCHEMBL690645 0.85 MAPK10 (0.49) MAPK10MAPK9ALKMAPK1MAPK3
SCHEMBL1293075 0.83 ALK (0.49) MAPK10MAPK9ALKMAPK1INSR
SCHEMBL691560 0.83 MAPK1 (0.48) MAPK10MAPK9MAPK1MAPK3PTK2
SCHEMBL22174599 0.80 MAPK10 (0.41) MAPK10MAPK9MAPK1MAPK3PTK2
SCHEMBL691660 0.80 MAPK3 (0.60) MAPK10MAPK9MAPK1MAPK3PTK2
SCHEMBL691689 0.78 MAPK1 (0.47) MAPK10MAPK9MAPK1MAPK3JAK2
SCHEMBL20312520 0.77 ALK (0.45) MAPK10MAPK9ALKMAPK1MAPK3
SCHEMBL12413670 0.77 MAPK10 (0.56) MAPK10MAPK9ALKMAPK1MAPK3
SCHEMBL1559161 0.73 MAPK9 (0.51) MAPK10MAPK9ALKMAPK1MAPK3

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 34 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140155410-A1 PYRAZOLYLAMINOPYRIDINES AS INHIBITORS OF FAK GLAXOSMITHKLINE LLC (US) 2014-06-05 US claimed
US-20140107131-A1 PYRAZOLYLAMINOPYRIDINES AS INHIBITORS OF FAK GLAXOSMITHKLINE LLC (US) 2014-04-17 US claimed
EP-2421537-A1 PYRAZOLYLAMINOPYRIDINES AS INHIBITORS OF FAK GlaxoSmithKline LLC (US) 2012-02-29 EP claimed
US-20110269774-A1 PYRAZOLYLAMINOPYRIDINES AS INHIBITORS OF FAK GLAXOSMITHKLINE LLC 2011-11-03 US claimed
US-20110207743-A1 PYRAZOLYLAMINOPYRIDINES AS INHIBITORS OF FAK GLAXOSMITHKLINE LLC 2011-08-25 US claimed
WO-2010062578-A1 PYRAZOLYLAMINOPYRIDINES AS INHIBITORS OF FAK GLAXOSMITHKLINE LLC (US) 2010-06-03 WO claimed
US-20100113475-A1 PYRAZOLYLAMINOPYRIDINES AS INHIBITORS OF FAK GLAXOSMITHKLINE LLC 2010-05-06 US claimed
US-11564927-B2 Therapeutic compositions, combinations, and methods of use VERASTEM, INC. (US) 2023-01-31 US disclosed
US-20220125788-A1 FAK inhibitor and drug combination thereof HINOVA PHARMACEUTICALS INC. (CN) 2022-04-28 US disclosed
US-20210030703-A1 USE OF CALORIC RESTRICTION MIMETICS FOR POTENTIATING CHEMO-IMMUNOTHERAPY FOR THE TREATMENT OF CANCERS INSERM (Institut National de la Santé et de la Recherche Médicale) (FR) 2021-02-04 US disclosed
US-20200330471-A1 THERAPEUTIC COMPOSITIONS, COMBINATIONS, AND METHODS OF USE RGCM SA LLC, AS PURCHASER AGENT 2020-10-22 US disclosed
WO-2020135442-A1 FAK INHIBITOR AND DRUG COMBINATION THEREOF 成都海创药业有限公司 2020-07-02 WO disclosed
US-20180177788-A1 THERAPEUTIC COMPOSITIONS, COMBINATIONS, AND METHODS OF USE RGCM SA LLC, AS PURCHASER AGENT 2018-06-28 US disclosed
US-20110269774-A1 PYRAZOLYLAMINOPYRIDINES AS INHIBITORS OF FAK GLAXOSMITHKLINE LLC 2011-11-03 US disclosed
US-20110269774-A1 PYRAZOLYLAMINOPYRIDINES AS INHIBITORS OF FAK GLAXOSMITHKLINE LLC 2011-11-03 US disclosed
US-20110207743-A1 PYRAZOLYLAMINOPYRIDINES AS INHIBITORS OF FAK GLAXOSMITHKLINE LLC 2011-08-25 US disclosed
US-20110207743-A1 PYRAZOLYLAMINOPYRIDINES AS INHIBITORS OF FAK GLAXOSMITHKLINE LLC 2011-08-25 US disclosed
US-20100113475-A1 PYRAZOLYLAMINOPYRIDINES AS INHIBITORS OF FAK GLAXOSMITHKLINE LLC 2010-05-06 US disclosed
US-20100113475-A1 PYRAZOLYLAMINOPYRIDINES AS INHIBITORS OF FAK GLAXOSMITHKLINE LLC 2010-05-06 US disclosed
US-20100113475-A1 PYRAZOLYLAMINOPYRIDINES AS INHIBITORS OF FAK GLAXOSMITHKLINE LLC 2010-05-06 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 (10 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-11564927-B2 Therapeutic compositions, combinations, and methods of use PTK2, CD274, PDCD1LG2 MAPK10 804/4885MAPK9 1136/4885ALK 1132/4885
US-20110269774-A1 PYRAZOLYLAMINOPYRIDINES AS INHIBITORS OF FAK PTK2, PAK1, CTTN MAPK10 656/4885MAPK9 386/4885ALK 665/4885
US-20210030703-A1 USE OF CALORIC RESTRICTION MIMETICS FOR POTENTIATING CHEMO-IMMUNOTHERAPY FOR THE TREATMENT OF CANCERS CD274, PDCD1, PDCD10 MAPK10 1805/4885MAPK9 3263/4885ALK 4801/4885
US-20100113475-A1 PYRAZOLYLAMINOPYRIDINES AS INHIBITORS OF FAK PTK2, PAK1, CTTN MAPK10 656/4885MAPK9 386/4885ALK 665/4885
US-20220125788-A1 FAK inhibitor and drug combination thereof CD274, PDCD1, PTK2 MAPK10 227/4885MAPK9 266/4885ALK 595/4885
US-20110207743-A1 PYRAZOLYLAMINOPYRIDINES AS INHIBITORS OF FAK PTK2, PAK1, CTTN MAPK10 656/4885MAPK9 386/4885ALK 665/4885
US-20200330471-A1 THERAPEUTIC COMPOSITIONS, COMBINATIONS, AND METHODS OF USE PTK2, CD274, PDCD1LG2 MAPK10 804/4885MAPK9 1136/4885ALK 1132/4885
US-20140107131-A1 PYRAZOLYLAMINOPYRIDINES AS INHIBITORS OF FAK PTK2, PAK1, CTTN MAPK10 656/4885MAPK9 386/4885ALK 665/4885
US-20140155410-A1 PYRAZOLYLAMINOPYRIDINES AS INHIBITORS OF FAK PTK2, PAK1, CTTN MAPK10 656/4885MAPK9 386/4885ALK 665/4885
US-20180177788-A1 THERAPEUTIC COMPOSITIONS, COMBINATIONS, AND METHODS OF USE PTK2, CD274, PDCD1LG2 MAPK10 804/4885MAPK9 1136/4885ALK 1132/4885

“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.