SCHEMBL1229728

SCHEMBL1229728

COC(=CC=Cc1cc2cc(Cl)c(Cl)cc2[nH]1)C(=O)NC1CC(C)(C)N(C)C(C)(C)C1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ATP6V1B1 P15313 5/20 0.80
ATP6AP1 Q15904 1/20 0.60
HDAC4 P56524 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34

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
SCHEMBL1229725 1.00 ATP6V1B1 (0.80) ATP6V1B1ATP6AP1HDAC4HDAC6
SCHEMBL6296395 1.00 ATP6V1B1 (0.80) ATP6V1B1ATP6AP1HDAC4HDAC6
SCHEMBL6296361 1.00 ATP6V1B1 (0.80) ATP6V1B1ATP6AP1HDAC4HDAC6
SCHEMBL1229727 1.00 ATP6V1B1 (0.80) ATP6V1B1ATP6AP1HDAC4HDAC6
SCHEMBL29546820 1.00 ATP6V1B1 (0.80) ATP6V1B1ATP6AP1HDAC4HDAC6
SCHEMBL2400959 0.90 ATP6V1B1 (0.64) ATP6V1B1ATP6AP1HDAC4HDAC6
SCHEMBL2400947 0.90 ATP6V1B1 (0.64) ATP6V1B1ATP6AP1HDAC4HDAC6
SCHEMBL2400954 0.90 ATP6V1B1 (0.64) ATP6V1B1ATP6AP1HDAC4HDAC6
SCHEMBL6295642 0.86 ATP6V1B1 (0.59) ATP6V1B1ATP6AP1HDAC4HDAC6
SCHEMBL6291994 0.86 ATP6V1B1 (0.60) ATP6V1B1ATP6AP1HDAC4HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210402002-A1 CONJUGATE GLYKOS BIOMEDICAL OY (FI) 2021-12-30 US claimed
US-20070299084-A1 Indole Derivatives Useful for Treating Resistance to Antitumor Agents NIKEM RESE S.R.L. (IT) 2007-12-27 US claimed
EP-1753420-A1 INDOLE DERIVATIVES USEFUL FOR TREATING RESISTANCE TO ANTITUMOUR AGENTS NIKEM RESEARCH S.R.L. (IT) 2007-02-21 EP claimed
WO-2005105078-A1 INDOLE DERIVATIVES USEFUL FOR TREATING RESISTANCE TO ANTITUMOUR AGENTS NIKEM RESEARCH S.R.L. (IT) 2005-11-10 WO claimed
US-6903117-B2 Indole derivatives for the treatment of osteoporosis NIKEM RESEARCH S.R.L. (IT) 2005-06-07 US claimed
EP-0914321-B1 INDOLE DERIVATIVES FOR THE TREATMENT OF OSTEOPOROSIS NIKEM RESEARCH SRL (IT) 2004-09-22 EP claimed
US-20220243177-A1 METHODS OF CULTURING QUIESCENT HEMATOPOIETIC STEM CELLS AND TREATMENT METHODS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2022-08-04 US disclosed
US-20210402002-A1 CONJUGATE GLYKOS BIOMEDICAL OY (FI) 2021-12-30 US disclosed
CN-112672764-A Conjugates 格莱科斯生物医药公司 2021-04-16 CN disclosed
US-20110038852-A1 ANTIVIRALS THAT TARGET TRANSPORTERS, CARRIERS, AND ION CHANNELS 3-V BIOSCIENCES, INC. (US) 2011-02-17 US disclosed
US-6903117-B2 Indole derivatives for the treatment of osteoporosis NIKEM RESEARCH S.R.L. (IT) 2005-06-07 US disclosed
EP-0914321-B1 INDOLE DERIVATIVES FOR THE TREATMENT OF OSTEOPOROSIS NIKEM RESEARCH SRL (IT) 2004-09-22 EP disclosed
US-20040010012-A1 Selective inhibitor of the biological activity of human osteoclast cells SMITHKLINE BEECHAM SPA 2004-01-15 US disclosed
US-20020173659-A1 Indole derivatives for the treatment of osteoporosis SMITH KLINE BEECHAM SPA 2002-11-21 US disclosed
EP-0914321-A1 INDOLE DERIVATIVES FOR THE TREATMENT OF OSTEOPOROSIS Smithkline Beecham S.p.A. (IT) 1999-05-12 EP disclosed
WO-1998001443-A1 INDOLE DERIVATIVES FOR THE TREATMENT OF OSTEOPOROSIS SMITHKLINE BEECHAM S.P.A. (IT) 1998-01-15 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 (4 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-20040010012-A1 Selective inhibitor of the biological activity of human osteoclast cells HRH4, HRH3, CNKSR1 ATP6V1B1 2556/4885ATP6AP1 2965/4885HDAC4 200/4885
US-20070299084-A1 Indole Derivatives Useful for Treating Resistance to Antitumor Agents IDO1, IDO2, INMT ATP6V1B1 3036/4885ATP6AP1 4182/4885HDAC4 766/4885
US-20210402002-A1 CONJUGATE ST6GAL1, CSGALNACT1, FUT6 ATP6V1B1 2049/4885ATP6AP1 4267/4885HDAC4 2398/4885
US-20020173659-A1 Indole derivatives for the treatment of osteoporosis SOST, GHRHR, EBP ATP6V1B1 2108/4885ATP6AP1 4110/4885HDAC4 276/4885

“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.