SCHEMBL9963871

SCHEMBL9963871

CC(C)(C)c1cnc(O)o1

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 5/20 0.34
ALOX15 P16050 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
CCNE2 O96020 4/20 0.32
CCNE1 P24864 4/20 0.32
CCNB2 O95067 3/20 0.32
CDK1 P06493 3/20 0.32
CDK4 P11802 3/20 0.32
CCNB1 P14635 3/20 0.32
CCND1 P24385 3/20 0.32
CCNB3 Q8WWL7 3/20 0.32
CCND2 P30279 1/20 0.32
CCND3 P30281 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL5727005 0.75 CDK2 (0.32) CDK2CCNE2CCNE1CCNB2CDK1
SCHEMBL9004255 0.75 CDK2 (0.35) CDK2
SCHEMBL5724820 0.74
SCHEMBL2616422 0.72 CDK2 (0.35) CDK2MEN1KMT2AL3MBTL1
SCHEMBL2619433 0.72 PIK3CG (0.41) CDK2
SCHEMBL21650121 0.71 CNR1 (0.33)
SCHEMBL21720208 0.70 CDK2 (0.34) CDK2L3MBTL1
SCHEMBL18647269 0.70 CDK2 (0.34) CDK2
SCHEMBL21720481 0.70 CDK2 (0.34) CDK2
SCHEMBL1979674 0.70 CDK2 (0.45) CDK2CCNE2CCNE1CCNB2CDK1

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 91 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10759813-B2 Neprilysin inhibitors THERAVANCE BIOPHARMA R&D IP, LLC (US) 2020-09-01 US disclosed
US-20200031847-A1 NEPRILYSIN INHIBITORS THERAVANCE BIOPHARMA R&D IP, LLC (US) 2020-01-30 US disclosed
US-10336773-B2 Neprilysin inhibitors THERAVANCE BIOPHARMA R&D IP, LLC (US) 2019-07-02 US disclosed
US-20180194776-A1 NEPRILYSIN INHIBITORS THERAVANCE BIOPHARMA R&D IP, LLC (US) 2018-07-12 US disclosed
US-20180194776-A1 NEPRILYSIN INHIBITORS THERAVANCE BIOPHARMA R&D IP, LLC (US) 2018-07-12 US disclosed
US-10011581-B2 Process for preparing 4-amino-5-biphenyl-4-yl-2-hydroxymethyl-2-methyl-pentanoic acid compound THERAVANCE BIOPHARMA R&D IP, LLC (US) 2018-07-03 US disclosed
US-10011581-B2 Process for preparing 4-amino-5-biphenyl-4-yl-2-hydroxymethyl-2-methyl-pentanoic acid compound THERAVANCE BIOPHARMA R&D IP, LLC (US) 2018-07-03 US disclosed
US-20180118705-A1 PROCESS FOR PREPARING 4-AMINO-5-BIPHENYL-4-YL-2-HYDROXYMETHYL-2-METHYL-PENTANOIC ACID COMPOUND THERAVANCE BIOPHARMA R&D IP, LLC (US) 2018-05-03 US disclosed
US-20180118705-A1 PROCESS FOR PREPARING 4-AMINO-5-BIPHENYL-4-YL-2-HYDROXYMETHYL-2-METHYL-PENTANOIC ACID COMPOUND THERAVANCE BIOPHARMA R&D IP, LLC (US) 2018-05-03 US disclosed
US-20180051023-A1 NEPRILYSIN INHIBITORS THERAVANCE BIOPHARMA R&D IP, LLC (US) 2018-02-22 US disclosed
US-7579488-B2 Vitamin D receptor modulators ELI LILLY AND COMPANY (US) 2009-08-25 US disclosed
US-7579488-B2 Vitamin D receptor modulators ELI LILLY AND COMPANY (US) 2009-08-25 US disclosed
US-20080200552-A1 Vitamin D Receptor Modulators ELI LILLY AND COMPANY (IN) 2008-08-21 US disclosed
US-20080200552-A1 Vitamin D Receptor Modulators ELI LILLY AND COMPANY (IN) 2008-08-21 US disclosed
US-20080119407-A1 Vitamin D Receptor Modulators ELI LILLY AND COMPANY 2008-05-22 US disclosed
US-20080119407-A1 Vitamin D Receptor Modulators ELI LILLY AND COMPANY 2008-05-22 US disclosed
US-20070149810-A1 Vitamin d receptor modulators ELI LILLY AND COMPANY (US) 2007-06-28 US disclosed
US-20070149810-A1 Vitamin d receptor modulators ELI LILLY AND COMPANY (US) 2007-06-28 US disclosed
US-20070106095-A1 Vitamin d receptor modulators ELI LILLY AND COMPANY 2007-05-10 US disclosed
US-20070106095-A1 Vitamin d receptor modulators ELI LILLY AND COMPANY 2007-05-10 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 (11 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-10759813-B2 Neprilysin inhibitors MME, REN, ACE CDK2 3302/4885ALOX15 3553/4885MEN1 688/4885
US-20080119407-A1 Vitamin D Receptor Modulators VDR, CYP2R1, CYP24A1 CDK2 2373/4885ALOX15 275/4885MEN1 3650/4885
US-20080200552-A1 Vitamin D Receptor Modulators VDR, CYP2R1, CYP24A1 CDK2 961/4885ALOX15 645/4885MEN1 2203/4885
US-10011581-B2 Process for preparing 4-amino-5-biphenyl-4-yl-2-hydroxymethyl-2-methyl-pentanoic acid compound CYP4B1, P2RX5, P2RX6 CDK2 806/4885ALOX15 1427/4885MEN1 1499/4885
US-20070106095-A1 Vitamin d receptor modulators VDR, CYP2R1, CYP24A1 CDK2 1392/4885ALOX15 561/4885MEN1 3024/4885
US-20180118705-A1 PROCESS FOR PREPARING 4-AMINO-5-BIPHENYL-4-YL-2-HYDROXYMETHYL-2-METHYL-PENTANOIC ACID COMPOUND CYP4B1, P2RX5, P2RX6 CDK2 806/4885ALOX15 1427/4885MEN1 1499/4885
US-20070149810-A1 Vitamin d receptor modulators VDR, CYP2R1, CYP24A1 CDK2 1541/4885ALOX15 542/4885MEN1 3208/4885
US-10336773-B2 Neprilysin inhibitors MME, REN, ACE CDK2 3302/4885ALOX15 3553/4885MEN1 688/4885
US-20180194776-A1 NEPRILYSIN INHIBITORS MME, REN, ACE CDK2 3302/4885ALOX15 3553/4885MEN1 688/4885
US-20200031847-A1 NEPRILYSIN INHIBITORS MME, REN, ACE CDK2 3302/4885ALOX15 3553/4885MEN1 688/4885
US-20180051023-A1 NEPRILYSIN INHIBITORS MME, REN, EDNRB CDK2 2905/4885ALOX15 4060/4885MEN1 726/4885

“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.