SCHEMBL4126678

SCHEMBL4126678

CC(C)Oc1cccc(N(C(N)=O)c2ccccc2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 1/20 0.46
RXRB P28702 1/20 0.46
ALOX5 P09917 2/20 0.45
KAT6A Q92794 1/20 0.44
ATM Q13315 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
IRAK4 Q9NWZ3 2/20 0.43
CETP P11597 1/20 0.43
BCHE P06276 1/20 0.43
ACHE P22303 1/20 0.43
PARP10 Q53GL7 1/20 0.42
ALDH1A1 P00352 4/20 0.41
KMT2A Q03164 3/20 0.41
LMNA P02545 2/20 0.41
MEN1 O00255 2/20 0.41
GAA P10253 2/20 0.41
TP53 P04637 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
NPC1 O15118 1/20 0.41

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
SCHEMBL28779265 0.85 CYP3A4 (0.50) ATMTDP1L3MBTL1BCHEACHE
SCHEMBL29090110 0.81 KMT2A (0.50) ATMTDP1L3MBTL1PARP10ALDH1A1
SCHEMBL28382188 0.79 PARP1 (0.56) L3MBTL1TP53HTTPRSS1
Methyl Alcohol SCHEMBL28147253 0.76 NPSR1 (0.58) ALOX5ATMTDP1L3MBTL1ALDH1A1
SCHEMBL75883 0.76 NPSR1 (0.64) ALOX5ATMTDP1L3MBTL1ALDH1A1
SCHEMBL75885 0.76 NPSR1 (0.64) ALOX5ATMTDP1L3MBTL1ALDH1A1
SCHEMBL28148401 0.76 NPSR1 (0.64) ALOX5ATMTDP1L3MBTL1ALDH1A1
SCHEMBL366746 0.76 PARP1 (0.47) ALDH1A1KMT2AMEN1SMN1; SMN2NPC1
SCHEMBL9795625 0.75 RXRA (0.44) RXRARXRBCETPBCHEACHE
SCHEMBL11207620 0.75 RAB9A (0.55) RXRARXRBATMTDP1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090239841-A1 Diaryl Ureas as CB1 Antagonists NEUROGEN CORPORATION 2009-09-24 US claimed

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-20090239841-A1 Diaryl Ureas as CB1 Antagonists CNR1, CNR2, OPRL1 RXRA 1457/4885RXRB 964/4885ALOX5 3537/4885

“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.