SCHEMBL2511238

SCHEMBL2511238

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

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.43
MAPK1 P28482 1/20 0.43
SCD O00767 1/20 0.43
EPHX2 P34913 3/20 0.39
LIPC P11150 1/20 0.37
LIPG Q9Y5X9 1/20 0.37
RBP4 P02753 1/20 0.37
TTR P02766 1/20 0.37
USP30 Q70CQ3 1/20 0.35
ALDH1A1 P00352 1/20 0.35
CTSS P25774 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
NPC1 O15118 1/20 0.34
KCNQ2 O43526 1/20 0.34
MEN1 O00255 1/20 0.34
LMNA P02545 1/20 0.34
KMT2A Q03164 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
SCHEMBL2510363 0.88 AAK1 (0.45) POLBMAPK1SCDCTSSMEN1
SCHEMBL2510364 0.88 AAK1 (0.45) POLBMAPK1SCDCTSSMEN1
SCHEMBL2505179 0.82 USP30 (0.41) POLBUSP30ALDH1A1MEN1KMT2A
SCHEMBL2508228 0.81 EPHX2 (0.42) POLBMAPK1SCDEPHX2USP30
SCHEMBL2502879 0.78 POLB (0.50) POLBMAPK1EPHX2ALDH1A1CTSS
SCHEMBL2544401 0.72 LIPC (0.36) POLBSCDEPHX2LIPCLIPG
SCHEMBL2509662 0.72 AAK1 (0.45) USP30CTSSMEN1KMT2A
SCHEMBL2509661 0.72 AAK1 (0.45) USP30CTSSMEN1KMT2A
SCHEMBL2507325 0.69 USP30 (0.39) POLBUSP30ALDH1A1
SCHEMBL2506699 0.69 CTSS (0.44) POLBMAPK1CTSSLMNA

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 POLB 1278/4885MAPK1 1094/4885SCD 1336/4885

“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.