SCHEMBL2945648

SCHEMBL2945648

O=C(NC1CC1)c1cccc(-c2ccc3c(N4CCOCC4)nncc3c2)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 8/20 1.00
KIT P10721 7/20 0.75
KDR P35968 7/20 0.75
MAPK9 P45984 4/20 0.75
LCK P06239 4/20 0.75
MTOR P42345 2/20 0.48
MAPK10 P53779 1/20 0.48
ATR Q13535 2/20 0.47
ATRIP Q8WXE1 1/20 0.47
BMPR1B O00238 1/20 0.46
BMPR1A P36894 1/20 0.46
TGFBR1 P36897 1/20 0.46
ACVRL1 P37023 1/20 0.46
ACVR1 Q04771 1/20 0.46
CYP2C19 P33261 1/20 0.44
GAA P10253 1/20 0.43
SCN9A Q15858 1/20 0.42
PLK4 O00444 1/20 0.42
JAK2 O60674 1/20 0.42
MAP4K4 O95819 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
SCHEMBL2945618 0.85 MAPK14 (1.00) MAPK14KITKDRMAPK9LCK
SCHEMBL2945941 0.85 MAPK14 (0.81) MAPK14KITKDRMAPK9LCK
SCHEMBL2953959 0.85 MAPK14 (0.81) MAPK14KITKDRMAPK9LCK
SCHEMBL2956864 0.83 MAPK14 (0.95) MAPK14KITKDRMAPK9LCK
SCHEMBL2944221 0.79 MAPK14 (0.69) MAPK14KITKDRMAPK9LCK
SCHEMBL2954097 0.79 MAPK14 (0.72) MAPK14KITKDRMAPK9LCK
SCHEMBL2948410 0.77 MAPK14 (0.79) MAPK14KITKDRMAPK9LCK
SCHEMBL12812018 0.76 MAPK14 (0.61) MAPK14KITKDRMAPK9LCK
SCHEMBL2945875 0.76 MAPK14 (0.84) MAPK14KITKDRMAPK9LCK
SCHEMBL2945992 0.75 MAPK14 (0.82) MAPK14KITKDRMAPK9LCK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1856058-B1 PHTHALAZINE, AZA- AND DIAZA-PHTHALAZINE COMPOUNDS AND METHODS OF USE AMGEN INC (US) 2014-09-03 EP disclosed
US-7759337-B2 Phthalazine compounds and methods of use AMGEN INC. (US) 2010-07-20 US disclosed
US-20060199817-A1 Phthalazine, aza- and diaza-phthalazine compounds and methods of use AMGEN INC. (US) 2006-09-07 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 (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-20060199817-A1 Phthalazine, aza- and diaza-phthalazine compounds and methods of use DAPK2, CDK2, DAPK1 MAPK14 293/4885KIT 1977/4885KDR 683/4885

“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.