SCHEMBL6017282

SCHEMBL6017282

CC(C)(C)OC(=O)NC(Cc1ccc(Cl)cc1)C(=O)N1CCN(c2cnnc3ccccc23)CC1

nearest known ligand 0.67

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 3/20 0.67
MC4R P32245 8/20 0.51
METAP1 P53582 1/20 0.46
KMT2A Q03164 2/20 0.46
HRH2 P25021 1/20 0.45
HRH1 P35367 1/20 0.45
SCN9A Q15858 1/20 0.44
MAPK1 P28482 1/20 0.44
AKT2 P31751 1/20 0.43
AKT1S1 Q96B36 1/20 0.43
AKT3 Q9Y243 1/20 0.43
MC5R P33032 1/20 0.43
MC3R P41968 1/20 0.43
PABPC1 P11940 1/20 0.42

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
SCHEMBL2798579 0.93 AKT1 (0.56) AKT1MC4RMETAP1KMT2AHRH2
SCHEMBL2797556 0.83 MC4R (0.49) AKT1MC4RMETAP1KMT2AHRH2
SCHEMBL2800764 0.83 MC4R (0.49) AKT1MC4RMETAP1KMT2AHRH2
SCHEMBL4510471 0.82 MC4R (0.56) MC4RKMT2AHRH2HRH1MAPK1
SCHEMBL4517707 0.80 MC4R (0.55) MC4RKMT2AHRH2HRH1MAPK1
SCHEMBL13229951 0.80 AKT1 (1.00) AKT1AKT2AKT1S1AKT3
SCHEMBL4511807 0.80 KDM4E (0.58) AKT1MC4RKMT2AHRH2HRH1
SCHEMBL4506745 0.80 MC4R (0.57) MC4RKMT2AHRH2HRH1MAPK1
Hydrochloric Acid SCHEMBL2797768 0.80 AKT1 (0.98) AKT1AKT2AKT1S1AKT3
SCHEMBL4510829 0.79 MC4R (0.55) MC4RKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160152576-A9 AKT PROTEIN KINASE INHIBITORS ARRAY BIOPHARMA, INC. (US) 2016-06-02 US disclosed
US-20140148436-A1 AKT PROTEIN KINASE INHIBITORS ARRAY BIOPHARMA, INC. (US) 2014-05-29 US disclosed
US-8680114-B2 AKT protein kinase inhibitors ARRAY BIOPHARMA, INC. (US) 2014-03-25 US disclosed
EP-1684694-A2 AKT PROTEIN KINASE INHIBITORS Array Biopharma, Inc. (US) 2006-08-02 EP disclosed
US-20050130954-A1 Serine/threonine protein kinase inhibitors; hyperproliferative disorder or inflammatory conditions; e.g. 4-(4-(2-amino-3-(p-chlorophenyl)-propionyl)-piperazin-1-yl)-quinazoline ARRAY BIOPHARMA INC. 2005-06-16 US disclosed
WO-2005051304-A2 AKT PROTEIN KINASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2005-06-09 WO 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 (3 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-20140148436-A1 AKT PROTEIN KINASE INHIBITORS AKT1, AKT2, AKT3 AKT1 1/4885MC4R 4675/4885METAP1 3615/4885
US-20160152576-A9 AKT PROTEIN KINASE INHIBITORS AKT1, AKT2, AKT3 AKT1 1/4885MC4R 4675/4885METAP1 3615/4885
US-20050130954-A1 Serine/threonine protein kinase inhibitors; hyperproliferative disorder or inflammatory conditions; e.g. 4-(4-(2-amino-3-(p-chlorophenyl)-propionyl)-piperazin-1-yl)-quinazoline MTOR, CDK2, CLK2 AKT1 25/4885MC4R 3848/4885METAP1 2823/4885

“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.