SCHEMBL3745836

SCHEMBL3745836

CCC(N)(NC(N)=O)c1ccccc1Oc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.50
NPSR1 Q6W5P4 1/20 0.50
CTNNB1 P35222 1/20 0.44
ATM Q13315 2/20 0.44
MEN1 O00255 1/20 0.42
MAPK1 P28482 1/20 0.42
KMT2A Q03164 1/20 0.42
ADRA2C P18825 1/20 0.42
POLB P06746 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
PARP10 Q53GL7 1/20 0.40
MMP1 P03956 1/20 0.39
MMP2 P08253 1/20 0.39
MMP13 P45452 1/20 0.39
NPC1 O15118 1/20 0.39
HPGD P15428 1/20 0.39
CRHBP P24387 1/20 0.39
RAB9A P51151 1/20 0.39
CRHR2 Q13324 1/20 0.39
GAA P10253 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
SCHEMBL2365010 0.73 L3MBTL1 (0.50) L3MBTL1NPSR1CTNNB1ATMMEN1
SCHEMBL14618085 0.70 RIPK1 (0.51) L3MBTL1NPSR1ATMMAPK1KMT2A
SCHEMBL8320818 0.69 RIPK1 (0.50) L3MBTL1NPSR1CTNNB1ATMMAPK1
Diphenylether SCHEMBL22720614 0.69 PARP10 (0.44) L3MBTL1NPSR1MEN1MAPK1KMT2A
SCHEMBL1821619 0.69 CTNNB1 (0.49) L3MBTL1NPSR1CTNNB1ATMKMT2A
SCHEMBL12585668 0.68 CTNNB1 (0.47) L3MBTL1NPSR1CTNNB1ATMMEN1
SCHEMBL9482735 0.68 L3MBTL1 (0.50) L3MBTL1NPSR1CTNNB1ATMPOLB
SCHEMBL27785393 0.67 CTNNB1 (0.46) L3MBTL1NPSR1CTNNB1ATMMEN1
Diphenylether SCHEMBL28218624 0.67 PARP10 (0.61) CTNNB1MEN1MAPK1KMT2ASMN1; SMN2
SCHEMBL3826083 0.66 ADRA2C (0.71) L3MBTL1CTNNB1ATMMEN1MAPK1

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-8410150-B2 Inhibitors of carnitine palmitoyltransferase and treating cancer UNIVERSITY HEALTH NETWORK (CA) 2013-04-02 US disclosed
US-20100105900-A1 INHIBITORS OF CARNITINE PALMITOYLTRANSFERASE AND TREATING CANCER UNIVERSITY HEALTH NETWORK 2010-04-29 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-20100105900-A1 INHIBITORS OF CARNITINE PALMITOYLTRANSFERASE AND TREATING CANCER CPT1A, CPT1B, CPT2 L3MBTL1 2733/4885NPSR1 4738/4885CTNNB1 3535/4885

“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.