SCHEMBL2605753

SCHEMBL2605753

CC(C)(C)NC(=O)C1(C(=O)Nc2ccccc2)CC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 3/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
CYP1A2 P05177 2/20 0.44
CYP2C19 P33261 2/20 0.44
EPHX1 P07099 2/20 0.44
MAPT P10636 2/20 0.44
ALDH1A1 P00352 1/20 0.44
CYP3A4 P08684 1/20 0.44
GAA P10253 1/20 0.44
CYP2D6 P10635 1/20 0.44
HPGD P15428 1/20 0.44
ALOX12 P18054 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
SPHK1 Q9NYA1 6/20 0.44
NAPRT Q6XQN6 1/20 0.43
HSD17B10 Q99714 1/20 0.43
TSHR P16473 2/20 0.42
PDK1 Q15118 2/20 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
SCHEMBL9304492 0.86 TSHR (0.54) CYP2C9SMN1; SMN2MEN1KMT2ACYP1A2
SCHEMBL12376632 0.86 MET (0.46) SMN1; SMN2MEN1KMT2AMAPTALDH1A1
SCHEMBL13342364 0.84 EGFR (0.47) SMN1; SMN2MEN1KMT2AMAPTALDH1A1
SCHEMBL13664096 0.82 HSP90AA1 (0.45) CYP2C9SMN1; SMN2MEN1KMT2ACYP1A2
SCHEMBL10202156 0.81 TSHR (0.48) CYP2C9SMN1; SMN2MEN1KMT2ACYP1A2
SCHEMBL24444629 0.80 LMNA (0.58) SMN1; SMN2MEN1KMT2AMAPTALDH1A1
SCHEMBL14817483 0.80 NAPRT (0.53) CYP2C9SMN1; SMN2MEN1KMT2ACYP1A2
SCHEMBL106428 0.79 SPHK1 (0.50) CYP2C9SMN1; SMN2MEN1KMT2ACYP1A2
SCHEMBL2605844 0.79 PDK1 (0.48) SMN1; SMN2MEN1KMT2AALDH1A1ALOX12
SCHEMBL17993520 0.78 NAPRT (0.47) CYP2C9SMN1; SMN2MEN1KMT2ACYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4251606-A1 HERBICIDAL MALONAMIDES BASF SE (DE) 2023-10-04 EP claimed
WO-2022112347-A1 HERBICIDAL MALONAMIDES BASF SE (DE) 2022-06-02 WO claimed
EP-4251606-A1 HERBICIDAL MALONAMIDES BASF SE (DE) 2023-10-04 EP disclosed
WO-2022112347-A1 HERBICIDAL MALONAMIDES BASF SE (DE) 2022-06-02 WO disclosed
US-8907091-B2 Processes and intermediates for preparing fused heterocyclic kinase inhibitors METHYLGENE INC. (CA) 2014-12-09 US disclosed
US-8404846-B2 Inhibitors of protein tyrosine kinase activity METHYLGENE INC. (CA) 2013-03-26 US disclosed
US-8404846-B2 Inhibitors of protein tyrosine kinase activity METHYLGENE INC. (CA) 2013-03-26 US disclosed
US-8329726-B2 Inhibitors of VEGF receptor and HGF receptor signaling METHYLGENE INC. (CA) 2012-12-11 US disclosed
US-20120095234-A1 PROCESSES AND INTERMEDIATES FOR PREPARING FUSED HETEROCYCLIC KINASE INHIBITORS Mirati Therapeutics, Inc. 2012-04-19 US disclosed
US-20120083482-A1 INHIBITORS OF VEGF RECEPTOR AND HGF RECEPTOR SIGNALING METHYLGENE INC. 2012-04-05 US disclosed
US-8093264-B2 Fused heterocycles as inhibitors of VEGF receptor and HGF receptor signaling METHYLGENE INC. (CA) 2012-01-10 US disclosed
US-8093264-B2 Fused heterocycles as inhibitors of VEGF receptor and HGF receptor signaling METHYLGENE INC. (CA) 2012-01-10 US disclosed
US-20110257100-A1 Inhibitors of Protein Tyrosine Kinase Activity METHYLGENE INC. (CA) 2011-10-20 US disclosed
US-20090286984-A1 Processes and intermediates for preparing fused heterocyclic kinase inhibitors Mirati Therapeutics, Inc. 2009-11-19 US disclosed
US-20090264440-A1 INHIBITORS OF PROTEIN TYROSINE KINASE ACTIVITY Mirati Therapeutics, Inc. 2009-10-22 US disclosed
US-20090264440-A1 INHIBITORS OF PROTEIN TYROSINE KINASE ACTIVITY Mirati Therapeutics, Inc. 2009-10-22 US disclosed
US-20080255155-A1 KINASE INHIBITORS AND USES THEREOF METHLYGENE INC. (CA) 2008-10-16 US disclosed
US-20070004675-A1 Inhibitors of VEGF receptor and HGF receptor signaling METHYLGENE, INC. 2007-01-04 US disclosed
US-20070004675-A1 Inhibitors of VEGF receptor and HGF receptor signaling METHYLGENE, INC. 2007-01-04 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 (7 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-20120095234-A1 PROCESSES AND INTERMEDIATES FOR PREPARING FUSED HETEROCYCLIC KINASE INHIBITORS MAP3K19, MAP3K9, MAP4K2 CYP2C9 744/4885SMN1; SMN2 3577/4885MEN1 1071/4885
US-20070004675-A1 Inhibitors of VEGF receptor and HGF receptor signaling HGF, MET, FLT1 CYP2C9 4759/4885SMN1; SMN2 4550/4885MEN1 3655/4885
US-20120083482-A1 INHIBITORS OF VEGF RECEPTOR AND HGF RECEPTOR SIGNALING HGF, MET, KDR CYP2C9 1518/4885SMN1; SMN2 3893/4885MEN1 4271/4885
US-20090286984-A1 Processes and intermediates for preparing fused heterocyclic kinase inhibitors MAP3K19, MAP3K9, MAP4K2 CYP2C9 744/4885SMN1; SMN2 3577/4885MEN1 1071/4885
US-20090264440-A1 INHIBITORS OF PROTEIN TYROSINE KINASE ACTIVITY HGF, ERBB2, MET CYP2C9 4358/4885SMN1; SMN2 4376/4885MEN1 3231/4885
US-20080255155-A1 KINASE INHIBITORS AND USES THEREOF ABL1, MAP3K20, MAP3K1 CYP2C9 4129/4885SMN1; SMN2 3336/4885MEN1 1165/4885
US-20110257100-A1 Inhibitors of Protein Tyrosine Kinase Activity ERBB2, ABL1, FLT1 CYP2C9 4211/4885SMN1; SMN2 4288/4885MEN1 3345/4885

“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.