SCHEMBL14856162

SCHEMBL14856162

CC(C)c1cc(C(=O)N2CCC(CN[C@@H](COC(C)(C)C)C(=O)O)CC2)c(O)cc1O

nearest known ligand 0.47

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 20/20 0.47
HSP90AB1 P08238 3/20 0.47
HSP90B1 P14625 7/20 0.39
HDAC8 Q9BY41 1/20 0.37

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
SCHEMBL17923376 1.00 HSP90AA1 (0.47) HSP90AA1HSP90AB1HSP90B1HDAC8
SCHEMBL14990911 0.92 HSP90AA1 (0.46) HSP90AA1HSP90AB1HSP90B1HDAC8
SCHEMBL17923359 0.92 HSP90AA1 (0.46) HSP90AA1HSP90AB1HSP90B1HDAC8
SCHEMBL14991295 0.91 HSP90AA1 (0.45) HSP90AA1HSP90AB1HSP90B1HDAC8
SCHEMBL14856715 0.88 HSP90AA1 (0.42) HSP90AA1HSP90AB1HSP90B1
SCHEMBL14856235 0.88 HSP90AA1 (0.49) HSP90AA1HSP90AB1HSP90B1HDAC8
SCHEMBL17923369 0.88 HSP90AA1 (0.49) HSP90AA1HSP90AB1HSP90B1HDAC8
SCHEMBL14856229 0.86 HSP90AA1 (0.52) HSP90AA1HSP90AB1HSP90B1HDAC8
SCHEMBL17923356 0.86 HSP90AA1 (0.52) HSP90AA1HSP90AB1HSP90B1HDAC8
SCHEMBL14856002 0.85 HSP90AA1 (0.51) HSP90AA1HSP90AB1HSP90B1HDAC8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160193200-A1 BENZAMIDE DERIVATIVES AND THEIR USE AS HSP90 INHIBTORS CHROMA THERAPEUTICS LTD. (GB) 2016-07-07 US claimed
US-9321718-B2 Benzamide derivatives and their use as HSP90 inhibtors CHROMA THERAPEUTICS LTD. (GB) 2016-04-26 US claimed
US-20130143926-A1 BENZAMIDE DERIVATIVES AND THEIR USE AS HSP90 INHIBTORS CHROMA THERAPEUTICS LTD. (GB) 2013-06-06 US claimed
US-20160193200-A1 BENZAMIDE DERIVATIVES AND THEIR USE AS HSP90 INHIBTORS CHROMA THERAPEUTICS LTD. (GB) 2016-07-07 US disclosed
US-9321718-B2 Benzamide derivatives and their use as HSP90 inhibtors CHROMA THERAPEUTICS LTD. (GB) 2016-04-26 US disclosed
US-20130143926-A1 BENZAMIDE DERIVATIVES AND THEIR USE AS HSP90 INHIBTORS CHROMA THERAPEUTICS LTD. (GB) 2013-06-06 US disclosed
EP-2580193-A1 BENZAMIDE DERIVATIVES AND THEIR USE AS HSP90 INHIBTORS Chroma Therapeutics Ltd. (GB) 2013-04-17 EP disclosed
WO-2011154708-A1 BENZAMIDE DERIVATIVES AND THEIR USE AS HSP90 INHIBTORS CHROMA THERAPEUTICS LTD (GB) 2011-12-15 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 (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-20160193200-A1 BENZAMIDE DERIVATIVES AND THEIR USE AS HSP90 INHIBTORS HSP90AB1, HSP90AA1, HSP90AB2P HSP90AA1 2/4885HSP90AB1 1/4885HSP90B1 4/4885
US-20130143926-A1 BENZAMIDE DERIVATIVES AND THEIR USE AS HSP90 INHIBTORS HSP90AB1, HSP90AA1, HSP90AB2P HSP90AA1 2/4885HSP90AB1 1/4885HSP90B1 4/4885

“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.