SCHEMBL17035978

SCHEMBL17035978

Cc1ccc2ncc(-c3cnn(C)c3)nc2n1

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FGFR3 P22607 12/20 0.57
KDR P35968 6/20 0.57
MAPK1 P28482 6/20 0.56
PIK3CA P42336 1/20 0.56
MAPK8 P45983 1/20 0.56
MAPK9 P45984 1/20 0.56
MAPK10 P53779 1/20 0.56
FGFR1 P11362 9/20 0.54
FGFR2 P21802 9/20 0.54
FGFR4 P22455 8/20 0.54
MET P08581 2/20 0.46
FLT3 P36888 2/20 0.46

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
SCHEMBL14901117 0.84 FGFR3 (0.63) FGFR3KDRMAPK1PIK3CAMAPK8
SCHEMBL15884313 0.84 FGFR3 (0.56) FGFR3KDRMAPK1PIK3CAMAPK8
SCHEMBL15884215 0.84 FGFR3 (0.56) FGFR3KDRMAPK1PIK3CAMAPK8
SCHEMBL17035979 0.81 MAPK1 (0.55) FGFR3KDRMAPK1PIK3CAMAPK8
SCHEMBL17035977 0.81 MAPK1 (0.60) FGFR3KDRMAPK1PIK3CAMAPK8
SCHEMBL17035976 0.77 FGFR3 (0.61) FGFR3KDRMAPK1PIK3CAMAPK8
SCHEMBL16257036 0.77 FGFR3 (0.72) FGFR3KDRMAPK1FGFR1FGFR2
SCHEMBL20571790 0.76 FGFR3 (0.49) FGFR3KDRMAPK1PIK3CAMAPK8
SCHEMBL24289863 0.75 FGFR3 (0.67) FGFR3KDRMAPK1FGFR1FGFR2
SCHEMBL29833181 0.75 FGFR3 (0.67) FGFR3KDRMAPK1FGFR1FGFR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2861584-B1 Pyridopyrazine and naphthyridine derivatives for the treatment of cancer ASTEX THERAPEUTICS LTD (GB) 2020-02-19 EP disclosed
US-9737544-B2 Compounds ASTEX THERAPEUTICS LIMITED (GB) 2017-08-22 US disclosed
US-9737544-B2 Compounds ASTEX THERAPEUTICS LIMITED (GB) 2017-08-22 US disclosed
US-20160213677-A1 NEW COMPOUNDS ASTEX THERAPEUTICS LIMITED (GB) 2016-07-28 US disclosed
US-20160213677-A1 NEW COMPOUNDS ASTEX THERAPEUTICS LIMITED (GB) 2016-07-28 US disclosed
US-9303030-B2 Compounds ASTEX THERAPEUTICS LIMITED (GB) 2016-04-05 US disclosed
US-9303030-B2 Compounds ASTEX THERAPEUTICS LIMITED (GB) 2016-04-05 US disclosed
US-20150239883-A1 NEW COMPOUNDS ASTEX THERAPEUTICS LIMITED (GB) 2015-08-27 US disclosed
US-20150239883-A1 NEW COMPOUNDS ASTEX THERAPEUTICS LIMITED (GB) 2015-08-27 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-20150239883-A1 NEW COMPOUNDS NTPCR, MT-ND5, NQO1 FGFR3 2473/4885KDR 2707/4885MAPK1 2950/4885
US-20160213677-A1 NEW COMPOUNDS NTPCR, MT-ND5, NQO1 FGFR3 2473/4885KDR 2707/4885MAPK1 2950/4885

“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.