SCHEMBL18549149

SCHEMBL18549149

O=C(C=Cc1cnc2c(c1)CCN2S(=O)(=O)c1cccc(F)c1)NO

nearest known ligand 0.67

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 16/20 0.67
HDAC3 O15379 11/20 0.67
HDAC4 P56524 11/20 0.67
HDAC7 Q8WUI4 11/20 0.67
HDAC2 Q92769 11/20 0.67
HDAC10 Q969S8 11/20 0.67
HDAC11 Q96DB2 11/20 0.67
HDAC8 Q9BY41 11/20 0.67
HDAC6 Q9UBN7 11/20 0.67
HDAC9 Q9UKV0 11/20 0.67
HDAC5 Q9UQL6 11/20 0.67
GPR183 P32249 1/20 0.46
CYP11B1 P15538 3/20 0.44
CYP11B2 P19099 1/20 0.43

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
SCHEMBL18549146 1.00 HDAC1 (0.67) HDAC1HDAC3HDAC4HDAC7HDAC2
SCHEMBL18549258 0.91 HDAC1 (0.80) HDAC1HDAC3HDAC4HDAC7HDAC2
SCHEMBL18549259 0.91 HDAC1 (0.80) HDAC1HDAC3HDAC4HDAC7HDAC2
SCHEMBL18549216 0.89 HDAC1 (0.67) HDAC1HDAC3HDAC4HDAC7HDAC2
SCHEMBL18549219 0.89 HDAC1 (0.67) HDAC1HDAC3HDAC4HDAC7HDAC2
SCHEMBL18549183 0.89 HDAC3 (0.52) HDAC1HDAC3HDAC4HDAC7HDAC2
SCHEMBL17173783 0.89 HDAC3 (0.52) HDAC1HDAC3HDAC4HDAC7HDAC2
SCHEMBL18549261 0.89 HDAC1 (0.69) HDAC1HDAC3HDAC4HDAC7HDAC2
SCHEMBL17173412 0.89 HDAC1 (0.69) HDAC1HDAC3HDAC4HDAC7HDAC2
SCHEMBL18549176 0.89 HDAC1 (0.67) HDAC1HDAC3HDAC4HDAC7HDAC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10246455-B2 Histone deacetylase inhibitors TAIPEI MEDICAL UNIVERSITY (TW) 2019-04-02 US disclosed
US-20170057956-A1 HISTONE DEACETYLASE INHIBITORS TAIPEI MEDICAL UNIVERSITY (TW) 2017-03-02 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 (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-10246455-B2 Histone deacetylase inhibitors HDAC1, HDAC2, HDAC5 HDAC1 1/4885HDAC3 4/4885HDAC4 9/4885
US-20170057956-A1 HISTONE DEACETYLASE INHIBITORS HDAC1, HDAC2, HDAC5 HDAC1 1/4885HDAC3 4/4885HDAC4 9/4885

“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.