SCHEMBL2239405

SCHEMBL2239405

O=C(O)N1CCN(C(=O)O)C(c2cccnc2Cc2ccccc2)C1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK1 P06493 2/20 0.36
IGF1R P08069 2/20 0.36
FGFR1 P11362 2/20 0.36
BRAF P15056 2/20 0.36
FGFR2 P21802 2/20 0.36
FGFR4 P22455 2/20 0.36
FGFR3 P22607 2/20 0.36
JAK1 P23458 2/20 0.36
CDK2 P24941 2/20 0.36
AXL P30530 2/20 0.36
CDK5 Q00535 2/20 0.36
PTK2B Q14289 2/20 0.36
ALDH1A1 P00352 3/20 0.36
KDM4E B2RXH2 2/20 0.36
SLC6A9 P48067 2/20 0.35
FNTA P49354 2/20 0.35
FNTB P49356 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
P2RX7 Q99572 1/20 0.35
CYP2D6 P10635 1/20 0.34

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
SCHEMBL27201661 0.73 ALDH1A1 (0.41) ALDH1A1KDM4EP2RX7
SCHEMBL21494223 0.70 TSHR (0.47) ALDH1A1KDM4E
SCHEMBL29007748 0.67 HSD11B1 (0.43) ALDH1A1SMN1; SMN2CYP2D6CYP3A4CYP2C9
SCHEMBL16333106 0.66 OPRM1 (0.40) ALDH1A1SMN1; SMN2
SCHEMBL27201684 0.64 HDAC4 (0.47) CDK2ALDH1A1KDM4ESMN1; SMN2HSD17B10
SCHEMBL258223 0.63 ALDH1A1 (0.55) ALDH1A1KDM4ESMN1; SMN2CYP3A4CYP2C9
SCHEMBL158842 0.63 POLB (0.49) ALDH1A1KDM4ESMN1; SMN2CYP3A4CYP2C9
SCHEMBL5765163 0.63 GABRA1 (0.56)
SCHEMBL17397770 0.63 MEN1 (0.40)
SCHEMBL6218871 0.63 RBP4 (0.40)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110212973-A1 CARBAMATE COMPOUND OR SALT THEREOF ASTELLAS PHARMA INC. (JP) 2011-09-01 US disclosed
EP-2351749-A1 CARBAMATE COMPOUND OR SALT THEREOF Astellas Pharma Inc. (JP) 2011-08-03 EP 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-20110212973-A1 CARBAMATE COMPOUND OR SALT THEREOF FAAH, FAAH2, TRPV1 CDK1 2752/4885IGF1R 4844/4885FGFR1 1579/4885

“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.