SCHEMBL2945892

SCHEMBL2945892

Cc1ccc(C(=O)O)cc1-c1ccc2c(N3CCOCC3)nncc2c1

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 16/20 0.78
KIT P10721 9/20 0.78
KDR P35968 8/20 0.78
MAPK9 P45984 6/20 0.78
LCK P06239 5/20 0.78
MAPK10 P53779 2/20 0.48
ALDH1A1 P00352 2/20 0.44
CYP1A2 P05177 2/20 0.44
ALOX15 P16050 2/20 0.44
CYP2C19 P33261 2/20 0.44
USP2 O75604 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2C9 P11712 1/20 0.44
TSHR P16473 1/20 0.44
MAPK1 P28482 1/20 0.44
CASP7 P55210 1/20 0.44
CLK4 Q9HAZ1 1/20 0.44
TP53 P04637 1/20 0.44
HSD17B10 Q99714 1/20 0.44
LYN P07948 1/20 0.43

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
SCHEMBL5256847 0.95 MAPK14 (0.72) MAPK14KITKDRMAPK9LCK
SCHEMBL2952099 0.91 MAPK14 (0.74) MAPK14KITKDRMAPK9LCK
SCHEMBL2944127 0.89 MAPK14 (0.80) MAPK14KITKDRMAPK9LCK
SCHEMBL2954539 0.89 MAPK14 (0.72) MAPK14KITKDRMAPK9LCK
SCHEMBL2945921 0.89 MAPK14 (0.71) MAPK14KITKDRMAPK9LCK
SCHEMBL2945618 0.88 MAPK14 (1.00) MAPK14KITKDRMAPK9LCK
SCHEMBL2951911 0.88 MAPK14 (0.62) MAPK14KITKDRMAPK9LCK
SCHEMBL2948571 0.87 MAPK14 (0.77) MAPK14KITKDRMAPK9LCK
SCHEMBL2954491 0.87 MAPK14 (0.77) MAPK14KITKDRMAPK9LCK
SCHEMBL2954517 0.87 MAPK14 (0.77) 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 5 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
EP-1856058-A2 PHTHALAZINE, AZA- AND DIAZA-PHTHALAZINE COMPOUNDS AND METHODS OF USE Amgen Inc. (US) 2007-11-21 EP disclosed
WO-2006094187-A2 PHTHALAZINE, AZA- AND DIAZA-PHTHALAZINE COMPOUNDS AND METHODS OF USE AMGEN INC (US) 2006-09-08 WO 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.