SCHEMBL2510364

SCHEMBL2510364

CCC(NC(=O)OC(C)(C)C)C(=O)Nc1cccc(C(F)(F)F)c1NCC1CC1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
AAK1 Q2M2I8 3/20 0.45
POLB P06746 2/20 0.43
LMNA P02545 1/20 0.43
SCN9A Q15858 7/20 0.42
CYP3A4 P08684 2/20 0.42
KMT2A Q03164 3/20 0.40
ATM Q13315 2/20 0.40
MAPK1 P28482 1/20 0.40
MEN1 O00255 1/20 0.39
TP53 P04637 1/20 0.39
MAPT P10636 1/20 0.39
SCD O00767 1/20 0.39
CTSS P25774 1/20 0.38
CTSK P43235 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
SCHEMBL2510363 1.00 AAK1 (0.45) AAK1POLBLMNASCN9ACYP3A4
SCHEMBL2511238 0.88 POLB (0.43) POLBLMNAKMT2AMAPK1MEN1
SCHEMBL2509661 0.85 AAK1 (0.45) AAK1SCN9AKMT2AATMMEN1
SCHEMBL2509662 0.85 AAK1 (0.45) AAK1SCN9AKMT2AATMMEN1
SCHEMBL2506697 0.83 CTSS (0.44) AAK1POLBLMNASCN9ACYP3A4
SCHEMBL2506699 0.83 CTSS (0.44) AAK1POLBLMNASCN9ACYP3A4
SCHEMBL2510362 0.80 POLB (0.43) AAK1POLBLMNASCN9ACYP3A4
SCHEMBL2507744 0.80 POLB (0.49) AAK1POLBLMNASCN9AMAPK1
SCHEMBL2507743 0.80 POLB (0.49) AAK1POLBLMNASCN9AMAPK1
SCHEMBL15597950 0.79 POLB (0.48) AAK1POLBLMNASCN9ACYP3A4

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-8575183-B2 Heterocyclic compounds and their uses AMGEN INC. (US) 2013-11-05 US disclosed
US-20110245257-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2011-10-06 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 (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-20110245257-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES MCL1, BCL9, MALT1 AAK1 836/4885POLB 1278/4885LMNA 2309/4885

“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.