SCHEMBL30480337

SCHEMBL30480337

CC(C)(C)OC(=O)N1CCCOc2cc(Br)ccc2C1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 1/20 0.49
NR1H2 P55055 1/20 0.48
MAPK1 P28482 1/20 0.43
RIPK1 Q13546 3/20 0.42
HDAC1 Q13547 1/20 0.42
ABHD6 Q9BV23 3/20 0.41
LMNA P02545 1/20 0.40
BACE1 P56817 2/20 0.39
USP2 O75604 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
USP30 Q70CQ3 2/20 0.39
NPC1 O15118 1/20 0.38
RAB9A P51151 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
SCHEMBL17959066 1.00 ESR2 (0.49) ESR2NR1H2MAPK1RIPK1HDAC1
SCHEMBL3276386 0.93 ESR2 (0.51) ESR2NR1H2MAPK1RIPK1HDAC1
SCHEMBL30405260 0.83 RIPK1 (0.48) ESR2NR1H2MAPK1RIPK1HDAC1
SCHEMBL856288 0.83 RIPK1 (0.48) ESR2NR1H2MAPK1RIPK1HDAC1
SCHEMBL17959028 0.81 HPGD (0.41) RIPK1ABHD6LMNASMN1; SMN2NPC1
SCHEMBL17991072 0.81 ESR2 (0.44) ESR2NR1H2MAPK1RIPK1LMNA
SCHEMBL24265586 0.81 NR1H2 (0.62) ESR2NR1H2MAPK1RIPK1HDAC1
SCHEMBL29574152 0.81 NR1H2 (0.62) ESR2NR1H2MAPK1RIPK1HDAC1
SCHEMBL1263385 0.81 ESR2 (0.63) ESR2NR1H2MAPK1RIPK1HDAC1
SCHEMBL2986459 0.80 ESR2 (0.65) ESR2NR1H2MAPK1RIPK1HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12304904-B2 Bicyclic [4,6,0] hydroxamic acids as HDAC inhibitors VALO HEALTH, INC. (US) 2025-05-20 US disclosed
US-20230357216-A1 BICYCLIC [4,6,0] HYDROXAMIC ACIDS AS HDAC INHIBITORS Valo Health, LLC 2023-11-09 US disclosed
US-11702412-B2 Bicyclic [4,6,0] hydroxamic acids as HDAC inhibitors VALO HEALTH, INC. (US) 2023-07-18 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-20230357216-A1 BICYCLIC [4,6,0] HYDROXAMIC ACIDS AS HDAC INHIBITORS HDAC1, HDAC2, HDAC4 ESR2 3331/4885NR1H2 228/4885MAPK1 3600/4885
US-12304904-B2 Bicyclic [4,6,0] hydroxamic acids as HDAC inhibitors HDAC1, HDAC2, HDAC4 ESR2 3331/4885NR1H2 228/4885MAPK1 3600/4885
US-11702412-B2 Bicyclic [4,6,0] hydroxamic acids as HDAC inhibitors HDAC1, HDAC2, HDAC4 ESR2 3331/4885NR1H2 228/4885MAPK1 3600/4885

“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.