SCHEMBL10272389

SCHEMBL10272389

CCOC(=O)N1CCc2nc(C)cnc2C1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 4/20 0.45
CYP1A2 P05177 2/20 0.45
CYP3A4 P08684 1/20 0.45
CACNA1C Q13936 1/20 0.45
SCN5A Q14524 1/20 0.45
SMN1; SMN2 Q16637 3/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
RXFP1 Q9HBX9 2/20 0.42
KDM4E B2RXH2 2/20 0.42
PIK3R1 P27986 1/20 0.42
PIK3CA P42336 1/20 0.42
RAB9A P51151 1/20 0.41
MAPT P10636 3/20 0.41
GAA P10253 3/20 0.41
POLB P06746 2/20 0.41
TSHR P16473 1/20 0.41
HSD17B10 Q99714 1/20 0.41
LMNA P02545 1/20 0.40
PABPC1 P11940 1/20 0.40
ATM Q13315 1/20 0.40

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
SCHEMBL1018183 0.88 RAB9A (0.47) GRM5CYP1A2CYP3A4CACNA1CSCN5A
SCHEMBL10209168 0.84 SLC6A15 (0.41) GRM5CYP1A2CYP3A4CACNA1CSCN5A
SCHEMBL1016251 0.84 HTT (0.48) GRM5CYP1A2CYP3A4CACNA1CSCN5A
SCHEMBL1017250 0.82 PIK3CA (0.52) SMN1; SMN2L3MBTL1RXFP1KDM4EPIK3R1
SCHEMBL15779200 0.82 RAB9A (0.47) GRM5CYP1A2CYP3A4CACNA1CSCN5A
SCHEMBL11066127 0.79 SMN1; SMN2 (0.45) SMN1; SMN2L3MBTL1KDM4EPIK3R1PIK3CA
SCHEMBL7328252 0.79 KDM4E (0.43) GRM5CYP1A2CYP3A4CACNA1CSCN5A
SCHEMBL15926459 0.78 SMN1; SMN2 (0.44) SMN1; SMN2L3MBTL1RXFP1KDM4ERAB9A
SCHEMBL15309449 0.76 ABHD6 (0.49) SMN1; SMN2L3MBTL1RXFP1KDM4EGAA
SCHEMBL10272393 0.76 SMN1; SMN2 (0.45) SMN1; SMN2L3MBTL1RXFP1KDM4ERAB9A

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-20120053201-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2012-03-01 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-20120053201-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF HDAC6, HDAC1, HDAC2 GRM5 483/4885CYP1A2 1215/4885CYP3A4 3110/4885

“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.