SCHEMBL12372229

SCHEMBL12372229

COC1CCN(c2cccc(B3OCC(C)(C)CO3)c2)C1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 3/20 0.40
IDH1 O75874 3/20 0.35
ACACB O00763 6/20 0.35
NTSR1 P30989 3/20 0.34
BPTF Q12830 1/20 0.33
ADORA2A P29274 1/20 0.33
MCHR1 Q99705 2/20 0.33

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
SCHEMBL1887404 0.86 USP30 (0.41) USP30IDH1ACACBNTSR1ADORA2A
SCHEMBL20004371 0.74 BPTF (0.57) USP30ACACBNTSR1BPTFADORA2A
SCHEMBL3121487 0.74 USP30 (0.47) USP30ACACBNTSR1ADORA2A
SCHEMBL18929109 0.73 ADRA2C (0.50) USP30ACACBNTSR1BPTFADORA2A
SCHEMBL25015826 0.73 NOTUM (0.57) USP30ACACBNTSR1
SCHEMBL7947367 0.72 USP30 (0.47) USP30ACACBNTSR1BPTFADORA2A
SCHEMBL16426133 0.72 SNCA (0.38)
SCHEMBL368100 0.71 LPL (0.33) USP30ACACBMCHR1
SCHEMBL13486520 0.70 NOTUM (0.50) USP30ACACBNTSR1
SCHEMBL24681269 0.70 USP30 (0.40) USP30

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8008298-B2 Pyrrolopyrazine kinase inhibitors Roche Palo Alto (US) 2011-08-30 US disclosed
US-8008298-B2 Pyrrolopyrazine kinase inhibitors Roche Palo Alto (US) 2011-08-30 US disclosed
US-20100267666-A1 Pyrrolopyrazine kinase inhibitors ROCHE PALO ALTO LLC 2010-10-21 US disclosed
US-20100267666-A1 Pyrrolopyrazine kinase inhibitors ROCHE PALO ALTO LLC 2010-10-21 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-20100267666-A1 Pyrrolopyrazine kinase inhibitors SYK, ZAP70, TYK2 USP30 957/4885IDH1 2093/4885ACACB 4042/4885

“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.