SCHEMBL626069

SCHEMBL626069

CC(C)(C)OC(=O)N1CCCC2Nc3ccccc3C2C1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 4/20 0.45
HPGDS O60760 2/20 0.45
MAPK1 P28482 1/20 0.45
PRMT5 O14744 1/20 0.43
WDR77 Q9BQA1 1/20 0.43
GPR119 Q8TDV5 1/20 0.43
JAK2 O60674 2/20 0.42
JAK1 P23458 2/20 0.42
ACKR3 P25106 1/20 0.42
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41
KMT2A Q03164 1/20 0.41
RORC P51449 1/20 0.41
KDM1A O60341 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
SCHEMBL627260 1.00 USP30 (0.45) USP30HPGDSMAPK1PRMT5WDR77
SCHEMBL627261 1.00 USP30 (0.45) USP30HPGDSMAPK1PRMT5WDR77
SCHEMBL626070 1.00 USP30 (0.45) USP30HPGDSMAPK1PRMT5WDR77
SCHEMBL626068 1.00 USP30 (0.45) USP30HPGDSMAPK1PRMT5WDR77
SCHEMBL5133257 0.93 GPR119 (0.47) USP30HPGDSMAPK1GPR119JAK2
SCHEMBL13944381 0.86 MAPK1 (0.49) USP30HPGDSMAPK1GPR119JAK2
SCHEMBL10127641 0.86 GPR119 (0.42) USP30HPGDSPRMT5WDR77GPR119
SCHEMBL7901892 0.79 MAPK1 (0.49) USP30HPGDSMAPK1PRMT5WDR77
SCHEMBL9966306 0.78 USP30 (0.46) USP30GPR119JAK2JAK1MAPT
SCHEMBL18345764 0.78 CNR1 (0.44) USP30MAPK1JAK2JAK1MEN1

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-20120040965-A1 SUBSTITUTED AZEPINO[4,3-B]INDOLES, PHARMACOLOGICAL COMPOSITION AND A METHOD FOR THE PRODUCTION AND USE THEREOF BORISOVICH FROLOV YEVGENIY (RU) 2012-02-16 US claimed
EP-2062895-A1 SUBSTITUTED AZEPINO[4,3-B]INDOLES, PHARMACOLOGICAL COMPOSITION AND A METHOD FOR THE PRODUCTION AND USE THEREOF Alla Chem, LLC. (US) 2009-05-27 EP 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-20120040965-A1 SUBSTITUTED AZEPINO[4,3-B]INDOLES, PHARMACOLOGICAL COMPOSITION AND A METHOD FOR THE PRODUCTION AND USE THEREOF ABCG2, HTR3C, AADAC USP30 2383/4885HPGDS 3220/4885MAPK1 2274/4885

“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.