SCHEMBL15935006

SCHEMBL15935006

C[C@@H]1CN(C(=O)OC(C)(C)C)CCN1c1ccc(N=O)nc1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 13/20 0.50
SMARCA2 P51531 1/20 0.46
SMARCA4 P51532 1/20 0.46
PBRM1 Q86U86 1/20 0.46
LMNA P02545 1/20 0.44
TP53 P04637 1/20 0.44
THRB P10828 1/20 0.44
MET P08581 1/20 0.42
ADAMTS5 Q9UNA0 1/20 0.42
CKS1B P61024 1/20 0.41
SKP1 P63208 1/20 0.41
SKP2 Q13309 1/20 0.41
ABCB1 P08183 1/20 0.40
MAPT P10636 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
SCHEMBL14925933 0.86 GPR119 (0.42) GPR119CKS1BSKP1SKP2MAPT
SCHEMBL25707196 0.85 GPR119 (0.54) GPR119SMARCA2SMARCA4PBRM1LMNA
SCHEMBL14927204 0.85 GPR119 (0.54) GPR119SMARCA2SMARCA4PBRM1LMNA
SCHEMBL31247616 0.84 GPR119 (0.52) GPR119SMARCA2SMARCA4PBRM1LMNA
SCHEMBL30176849 0.84 SMARCA2 (0.54) GPR119SMARCA2SMARCA4PBRM1LMNA
SCHEMBL14912467 0.84 SMARCA2 (0.54) GPR119SMARCA2SMARCA4PBRM1LMNA
SCHEMBL14912289 0.84 SMARCA2 (0.54) GPR119SMARCA2SMARCA4PBRM1LMNA
SCHEMBL14924376 0.84 SMARCA2 (0.54) GPR119SMARCA2SMARCA4PBRM1LMNA
SCHEMBL30512308 0.84 SMARCA2 (0.54) GPR119SMARCA2SMARCA4PBRM1LMNA
SCHEMBL24649919 0.82 GPR119 (0.52) GPR119SMARCA2SMARCA4PBRM1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2773639-B1 ALKYLATED PIPERAZINE COMPOUNDS AS INHIBITORS OF BTK ACTIVITY HOFFMANN LA ROCHE (CH) 2017-04-26 EP disclosed
US-9115152-B2 Alkylated piperazine compounds GENENTECH, INC. (US) 2015-08-25 US disclosed
US-20150094302-A1 ALKYLATED PIPERAZINE COMPOUNDS GENENTECH, INC. (US) 2015-04-02 US disclosed
US-8946213-B2 Alkylated piperazine compounds GENENTECH, INC. (US) 2015-02-03 US disclosed
US-20140221365-A1 ALKYLATED PIPERAZINE COMPOUNDS GENENTECH, INC. (US) 2014-08-07 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 (2 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-20140221365-A1 ALKYLATED PIPERAZINE COMPOUNDS BTK, SYK, LCK GPR119 2675/4885SMARCA2 2868/4885SMARCA4 2713/4885
US-20150094302-A1 ALKYLATED PIPERAZINE COMPOUNDS BTK, SYK, LCK GPR119 2675/4885SMARCA2 2868/4885SMARCA4 2713/4885

“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.