SCHEMBL22441219

SCHEMBL22441219

COC(=O)c1ccc(CNC23CC(C2)C3)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC6 Q9UBN7 4/20 0.59
▸ HDAC8 Q9BY41 3/20 0.55
▸ LOXL2 Q9Y4K0 1/20 0.54
▸ LMNA P02545 2/20 0.52
▸ ALDH1A1 P00352 2/20 0.52
▸ EPHX2 P34913 1/20 0.50
▸ HDAC1 Q13547 2/20 0.49
▸ CA1 P00915 4/20 0.49
▸ CA2 P00918 4/20 0.49
▸ HPGD P15428 1/20 0.47
▸ CNR2 P34972 1/20 0.47
▸ CYP4A11 Q02928 2/20 0.46
▸ HDAC3 O15379 1/20 0.45
▸ CYP4F2 P78329 1/20 0.45
▸ KMT2A Q03164 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ MAPT P10636 1/20 0.44
▸ TDP1 Q9NUW8 1/20 0.43
▸ CA12 O43570 1/20 0.43
▸ CA7 P43166 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
SCHEMBL2403036 0.94 HDAC6 (0.68) HDAC6HDAC8LOXL2LMNAALDH1A1
SCHEMBL1421044 0.82 HDAC6 (0.64) HDAC6HDAC8LMNAALDH1A1EPHX2
SCHEMBL16884347 0.81 HDAC6 (0.56) HDAC6HDAC8LOXL2LMNAALDH1A1
SCHEMBL15009111 0.81 HDAC6 (0.50) HDAC6HDAC8LOXL2LMNAALDH1A1
SCHEMBL24419731 0.80 EPHX2 (0.55) HDAC6LOXL2LMNAALDH1A1EPHX2
SCHEMBL15029019 0.79 HDAC6 (0.72) HDAC6HDAC8LMNAALDH1A1EPHX2
SCHEMBL34473629 0.78 CNR2 (0.51) HDAC6HDAC8LMNAALDH1A1EPHX2
SCHEMBL1421158 0.77 HDAC6 (0.74) HDAC6HDAC8LMNAALDH1A1EPHX2
SCHEMBL15029094 0.76 HDAC6 (0.72) HDAC6HDAC8LMNAALDH1A1EPHX2
SCHEMBL21712145 0.75 HDAC6 (1.00) HDAC6HDAC8HDAC1CNR2HDAC3

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
EP-3931183-B1 COMPOUNDS WITH FERROPTOSIS INDUCING ACTIVITY AND METHODS OF THEIR USE FERRO THERAPEUTICS INC (US) 2025-02-12 — — EP disclosed
US-20220002280-A1 COMPOUNDS AND METHODS OF USE FERRO THERAPEUTICS INC (US) 2022-01-06 — — US disclosed
US-20220002280-A1 COMPOUNDS AND METHODS OF USE FERRO THERAPEUTICS INC (US) 2022-01-06 — — US disclosed
US-11040964-B2 Compounds and methods of use Ferro Therapeutics, Inc. (US) 2021-06-22 — — US disclosed
US-11040964-B2 Compounds and methods of use Ferro Therapeutics, Inc. (US) 2021-06-22 — — US disclosed
US-20200299283-A1 COMPOUNDS AND METHODS OF USE BRIDGEBIO PHARMA, INC. 2020-09-24 — — US disclosed
US-20200299283-A1 COMPOUNDS AND METHODS OF USE BRIDGEBIO PHARMA, INC. 2020-09-24 — — 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-20220002280-A1 COMPOUNDS AND METHODS OF USE AIFM2, GPX4, GPX1 HDAC6 510/4885HDAC8 322/4885LOXL2 558/4885
US-20200299283-A1 COMPOUNDS AND METHODS OF USE AIFM2, GPX4, GPX1 HDAC6 510/4885HDAC8 322/4885LOXL2 558/4885
US-11040964-B2 Compounds and methods of use AIFM2, GPX4, GPX1 HDAC6 510/4885HDAC8 322/4885LOXL2 558/4885

“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.

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