SCHEMBL980236

SCHEMBL980236

CCOC(=O)CC1(N)CCN(C(=O)O)C1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.40
KMT2A Q03164 1/20 0.40
GAA P10253 3/20 0.39
ALOX15 P16050 1/20 0.37
TSHR P16473 2/20 0.36
POLB P06746 2/20 0.36
LMNA P02545 1/20 0.36
ALDH1A1 P00352 4/20 0.35
MGAM O43451 1/20 0.34
SI P14410 1/20 0.34
MGAM2 Q2M2H8 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
RAB9A P51151 1/20 0.33
APP P05067 1/20 0.33
KDM4E B2RXH2 1/20 0.33
OPRM1 P35372 1/20 0.33
HTT P42858 1/20 0.33
CYP1A2 P05177 1/20 0.33
TRPA1 O75762 1/20 0.32

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
SCHEMBL979849 0.87 L3MBTL1 (0.44) L3MBTL1KMT2AGAAALOX15TSHR
SCHEMBL22491911 0.81 L3MBTL1 (0.43) L3MBTL1KMT2AGAAALOX15TSHR
SCHEMBL978529 0.78 SMN1; SMN2 (0.47) L3MBTL1KMT2AGAATSHRPOLB
SCHEMBL1728632 0.78 L3MBTL1 (0.39) L3MBTL1KMT2AGAAALOX15TSHR
SCHEMBL980391 0.77 OPRM1 (0.44) L3MBTL1KMT2AGAATSHRPOLB
SCHEMBL27144756 0.76 L3MBTL1 (0.38) L3MBTL1KMT2AGAAALOX15TSHR
SCHEMBL15774802 0.76 CYP2D6 (0.33) KMT2ATSHRALDH1A1SMN1; SMN2RAB9A
SCHEMBL16276877 0.75 GAA (0.48) L3MBTL1KMT2AGAAALOX15TSHR
SCHEMBL979519 0.75 KMT2A (0.40) L3MBTL1KMT2AGAAALOX15MGAM
SCHEMBL21551293 0.75 SMN1; SMN2 (0.43) L3MBTL1KMT2AGAATSHRLMNA

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-8680282-B2 Cyclic inhibitors of carnitine palmitoyltransferase and treating cancer UNIVERSITY HEALTH NETWORK (CA) 2014-03-25 US disclosed
US-20110015174-A1 CYCLIC INHIBITORS OF CARNITINE PALMITOYLTRANSFERASE AND TREATING CANCER UNIVERSITY HEALTH NETWORK (CA) 2011-01-20 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-20110015174-A1 CYCLIC INHIBITORS OF CARNITINE PALMITOYLTRANSFERASE AND TREATING CANCER CPT1A, CPT1B, CPT2 L3MBTL1 2605/4885KMT2A 1063/4885GAA 1954/4885

“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.