SCHEMBL17356908

SCHEMBL17356908

CC1=C(C(=O)NO)CCCC1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 9/20 0.41
HDAC8 Q9BY41 6/20 0.41
HDAC4 P56524 5/20 0.41
HDAC2 Q92769 3/20 0.41
HDAC1 Q13547 6/20 0.38
HDAC3 O15379 1/20 0.38
HDAC7 Q8WUI4 1/20 0.38
HDAC5 Q9UQL6 1/20 0.38
SLC6A3 Q01959 4/20 0.33
SLC6A2 P23975 3/20 0.32
SLC6A4 P31645 1/20 0.32
ACHE P22303 1/20 0.32
GABRR1 P24046 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
SCHEMBL17356892 0.82 BRD4 (0.39) HDAC6HDAC8HDAC2ACHE
SCHEMBL22744089 0.75
SCHEMBL1875182 0.74 DHODH (0.44) HDAC6HDAC8HDAC4HDAC2HDAC1
SCHEMBL17356909 0.74 HDAC6 (0.42) HDAC6HDAC8HDAC4HDAC2HDAC1
SCHEMBL1782265 0.73 SLC6A3 (0.31) SLC6A3
SCHEMBL757738 0.73 POLB (0.35) SLC6A3SLC6A2SLC6A4
SCHEMBL10592697 0.73 POLB (0.33)
SCHEMBL8321167 0.73 HDAC8 (0.41) HDAC6HDAC8HDAC4HDAC2HDAC1
SCHEMBL819039 0.73 SLC6A3 (0.47) SLC6A3SLC6A2SLC6A4ACHE
SCHEMBL8041732 0.71 SLC6A3 (0.31) SLC6A3SLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10793538-B2 Cycloalkenyl hydroxamic acid derivatives and their use as histone deacetylase inhibitors THE BROAD INSTITUTE, INC. (US) 2020-10-06 US disclosed
US-20180215726-A1 CYCLOALKENYL HYDROXAMIC ACID DERIVATIVES AND THEIR USE AS HISTONE DEACETYLASE INHIBITORS THE BROAD INSTITUTE, INC. (US) 2018-08-02 US disclosed
US-20180215726-A1 CYCLOALKENYL HYDROXAMIC ACID DERIVATIVES AND THEIR USE AS HISTONE DEACETYLASE INHIBITORS THE BROAD INSTITUTE, INC. (US) 2018-08-02 US disclosed
US-9914717-B2 Cycloalkenyl hydroxamic acid derivatives and their use as histone deacetylase inhibitors THE BROAD INSTITUTE, INC. (US) 2018-03-13 US disclosed
US-9914717-B2 Cycloalkenyl hydroxamic acid derivatives and their use as histone deacetylase inhibitors THE BROAD INSTITUTE, INC. (US) 2018-03-13 US disclosed
US-20150368221-A1 CYCLOALKENYL HYDROXAMIC ACID DERIVATIVES AND THEIR USE AS HISTONE DEACETYLASE INHIBITORS THE BROAD INSTITUTE, INC. 2015-12-24 US disclosed
US-20150368221-A1 CYCLOALKENYL HYDROXAMIC ACID DERIVATIVES AND THEIR USE AS HISTONE DEACETYLASE INHIBITORS THE BROAD INSTITUTE, INC. 2015-12-24 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 (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-20180215726-A1 CYCLOALKENYL HYDROXAMIC ACID DERIVATIVES AND THEIR USE AS HISTONE DEACETYLASE INHIBITORS HDAC1, HDAC3, HDAC7 HDAC6 9/4885HDAC8 8/4885HDAC4 10/4885
US-20150368221-A1 CYCLOALKENYL HYDROXAMIC ACID DERIVATIVES AND THEIR USE AS HISTONE DEACETYLASE INHIBITORS HDAC1, HDAC3, HDAC7 HDAC6 10/4885HDAC8 9/4885HDAC4 8/4885
US-10793538-B2 Cycloalkenyl hydroxamic acid derivatives and their use as histone deacetylase inhibitors HDAC1, HDAC3, HDAC7 HDAC6 9/4885HDAC8 8/4885HDAC4 10/4885

“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.