SCHEMBL20096499

SCHEMBL20096499

O=C(O)c1cccc2c1CC1(CC2)CCN(c2cccc(C(F)(F)F)c2)C1=O

nearest known ligand 0.70

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HDAC11 Q96DB2 5/20 0.70
NOTUM Q6P988 2/20 0.41
CYP17A1 P05093 1/20 0.40
ALDH1A1 P00352 3/20 0.40
DRD2 P14416 1/20 0.39
DRD3 P35462 1/20 0.39
KCNH2 Q12809 1/20 0.39
ALKBH5 Q6P6C2 1/20 0.39
CXCR5 P32302 1/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
MAPK1 P28482 1/20 0.39
POLB P06746 1/20 0.39
USP30 Q70CQ3 1/20 0.38
TSHR P16473 1/20 0.38
HTT P42858 1/20 0.38
KDM4E B2RXH2 1/20 0.38
MAPT P10636 1/20 0.38
CFTR P13569 1/20 0.38

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
SCHEMBL20096501 0.91 HDAC11 (0.86) HDAC11CYP17A1ALDH1A1CXCR5
SCHEMBL20096500 0.90 HDAC11 (0.68) HDAC11CYP17A1ALDH1A1MEN1KMT2A
SCHEMBL20096629 0.83 HDAC11 (1.00) HDAC11DRD2DRD3KCNH2CXCR5
SCHEMBL20096495 0.82 HDAC11 (0.71) HDAC11CXCR5
SCHEMBL20096682 0.82 HDAC11 (1.00) HDAC11CYP17A1DRD2DRD3KCNH2
SCHEMBL20096680 0.82 HDAC11 (0.78) HDAC11CYP17A1POLBUSP30TSHR
SCHEMBL20096890 0.80 HDAC11 (1.00) HDAC11
SCHEMBL20096891 0.80 HDAC11 (0.78) HDAC11CFTR
SCHEMBL29754239 0.77 HDAC11 (0.83) HDAC11DRD2
SCHEMBL20096690 0.77 HDAC11 (0.83) HDAC11DRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11345672-B2 Methods using HDAC11 inhibitors VALO HEALTH, INC. (US) 2022-05-31 US disclosed
US-20190084946-A1 METHODS USING HDAC11 INHIBITORS Valo Health, LLC 2019-03-21 US disclosed
US-20190084945-A1 METHODS USING HDAC11 INHIBITORS VALO HEALTH, INC. 2019-03-21 US disclosed
US-20190084945-A1 METHODS USING HDAC11 INHIBITORS VALO HEALTH, INC. 2019-03-21 US disclosed
WO-2018075959-A1 METHODS USING HDAC11 INHIBITORS FORMA THERAPEUTICS, INC. (US) 2018-04-26 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 (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-11345672-B2 Methods using HDAC11 inhibitors HDAC11, HDAC1, HDAC10 HDAC11 1/4885NOTUM 3113/4885CYP17A1 1698/4885
US-20190084945-A1 METHODS USING HDAC11 INHIBITORS HDAC11, HDAC1, HDAC10 HDAC11 1/4885NOTUM 3113/4885CYP17A1 1698/4885
US-20190084946-A1 METHODS USING HDAC11 INHIBITORS HDAC11, HDAC1, HDAC10 HDAC11 1/4885NOTUM 3113/4885CYP17A1 1698/4885

“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.