SCHEMBL18085923

SCHEMBL18085923

CN(CCc1cn(C)c2ccccc12)Cc1ccc(/C=C/C(=O)NO)cc1

nearest known ligand 0.68

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ HDAC1 Q13547 18/20 0.68
▸ HDAC6 Q9UBN7 16/20 0.68
▸ HDAC2 Q92769 15/20 0.68
▸ HDAC3 O15379 11/20 0.68
▸ HDAC4 P56524 10/20 0.68
▸ HDAC7 Q8WUI4 10/20 0.68
▸ HDAC8 Q9BY41 10/20 0.68
▸ HDAC9 Q9UKV0 10/20 0.68
▸ HDAC5 Q9UQL6 10/20 0.68
▸ HDAC10 Q969S8 9/20 0.68
▸ HDAC11 Q96DB2 9/20 0.68
▸ KCNH2 Q12809 4/20 0.52
▸ CYP3A4 P08684 1/20 0.49

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
SCHEMBL18085938 0.81 HDAC1 (1.00) HDAC1HDAC6HDAC2HDAC3HDAC4
SCHEMBL13949851 0.80 HDAC1 (0.79) HDAC1HDAC6HDAC2HDAC3HDAC4
SCHEMBL18088396 0.79 HTR6 (0.56) —
SCHEMBL5991373 0.78 HDAC1 (0.54) HDAC1HDAC6HDAC2HDAC3HDAC4
SCHEMBL5991382 0.78 HDAC1 (0.54) HDAC1HDAC6HDAC2HDAC3HDAC4
SCHEMBL13949775 0.76 HDAC3 (0.65) HDAC1HDAC6HDAC2HDAC3HDAC4
SCHEMBL20683101 0.76 HTR2A (0.48) —
SCHEMBL18085890 0.76 ALDH1A1 (0.49) —
SCHEMBL5991047 0.75 HDAC1 (0.52) HDAC1HDAC6HDAC2HDAC3HDAC4
SCHEMBL5991054 0.75 HDAC1 (0.52) HDAC1HDAC6HDAC2HDAC3HDAC4

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-20210030899-A1 IMAGING HISTONE DEACETYLASES WITH A RADIOTRACER USING POSITRON EMISSION TOMOGRAPHY THE GENERAL HOSPITAL CORPORATION 2021-02-04 — — US disclosed
US-10842891-B2 Imaging histone deacetylases with a radiotracer using positron emission tomography THE GENERAL HOSPITAL CORPORATION (US) 2020-11-24 — — US disclosed
US-20190240357-A1 IMAGING HISTONE DEACETYLASES WITH A RADIOTRACER USING POSITRON EMISSION TOMOGRAPHY THE GENERAL HOSPITAL CORPORATION 2019-08-08 — — US disclosed
US-10188756-B2 Imaging histone deacetylases with a radiotracer using positron emission tomography THE GENERAL HOSPITAL CORPORATION (US) 2019-01-29 — — US disclosed
US-20160271276-A1 IMAGING HISTONE DEACETYLASES WITH A RADIOTRACER USING POSITRON EMISSION TOMOGRAPHY THE GENERAL HOSPITAL CORPORATION 2016-09-22 — — US disclosed
US-20160271276-A1 IMAGING HISTONE DEACETYLASES WITH A RADIOTRACER USING POSITRON EMISSION TOMOGRAPHY THE GENERAL HOSPITAL CORPORATION 2016-09-22 — — 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 (5 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-20190240357-A1 IMAGING HISTONE DEACETYLASES WITH A RADIOTRACER USING POSITRON EMISSION TOMOGRAPHY HDAC1, HDAC11, HDAC3 HDAC1 1/4885HDAC6 13/4885HDAC2 4/4885
US-10188756-B2 Imaging histone deacetylases with a radiotracer using positron emission tomography HDAC1, HDAC11, HDAC3 HDAC1 1/4885HDAC6 13/4885HDAC2 4/4885
US-20210030899-A1 IMAGING HISTONE DEACETYLASES WITH A RADIOTRACER USING POSITRON EMISSION TOMOGRAPHY HDAC1, HDAC11, HDAC3 HDAC1 1/4885HDAC6 13/4885HDAC2 4/4885
US-20160271276-A1 IMAGING HISTONE DEACETYLASES WITH A RADIOTRACER USING POSITRON EMISSION TOMOGRAPHY HDAC1, HDAC11, HDAC3 HDAC1 1/4885HDAC6 13/4885HDAC2 4/4885
US-10842891-B2 Imaging histone deacetylases with a radiotracer using positron emission tomography HDAC1, HDAC11, HDAC3 HDAC1 1/4885HDAC6 13/4885HDAC2 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.

Send feedback