SCHEMBL21835783

SCHEMBL21835783

CCOC(=O)c1cc2ccc(NCCN(C)C)cc2cn1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC2 Q92769 1/20 0.50
▸ POLB P06746 2/20 0.48
▸ RAD52 P43351 2/20 0.48
▸ KMT2A Q03164 3/20 0.46
▸ KDM4E B2RXH2 3/20 0.46
▸ MEN1 O00255 2/20 0.46
▸ GAA P10253 1/20 0.46
▸ LMNA P02545 3/20 0.42
▸ CYP1A2 P05177 2/20 0.42
▸ MAOA P21397 1/20 0.42
▸ CNR1 P21554 1/20 0.42
▸ DRD4 P21917 1/20 0.42
▸ ACHE P22303 1/20 0.42
▸ HRH2 P25021 1/20 0.42
▸ HTR2A P28223 1/20 0.42
▸ HTR2C P28335 1/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ NTSR1 P30989 1/20 0.42
▸ HRH1 P35367 1/20 0.42
▸ DRD3 P35462 1/20 0.42

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
SCHEMBL21835802 0.84 HDAC2 (0.54) HDAC2RAD52SIGMAR1MCHR1ABL1
SCHEMBL28911125 0.83 KMT2A (0.48) POLBRAD52KMT2AKDM4EMEN1
SCHEMBL21835789 0.79 MAOB (0.52) POLBRAD52KMT2AKDM4EMEN1
SCHEMBL5067501 0.76 LMNA (0.67) POLBKMT2AKDM4EMEN1GAA
SCHEMBL21885348 0.74 ALOX15 (0.50) KDM4ELMNACYP1A2MAPK1GABRP
SCHEMBL4538233 0.74 ALDH1A1 (0.53) KDM4EGAALMNACYP1A2MAPK1
SCHEMBL30712292 0.73 GABRA1 (0.59) POLBKMT2AKDM4EMEN1GAA
SCHEMBL30712301 0.73 GABRA1 (0.59) POLBKMT2AKDM4EMEN1GAA
SCHEMBL2201127 0.73 GABRA1 (0.59) POLBKMT2AKDM4EMEN1GAA
SCHEMBL22395353 0.72 GABRA1 (0.49) KDM4ELMNACYP1A2RAB9AGABRP

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-11858919-B2 HDAC1,2 inhibitors REGENACY PHARMACEUTICALS, INC. (US) 2024-01-02 — — US disclosed
US-11858919-B2 HDAC1,2 inhibitors REGENACY PHARMACEUTICALS, INC. (US) 2024-01-02 — — US disclosed
US-20220033388-A1 HDAC1,2 Inhibitors REGENACY PHARMACEUTICALS, LLC 2022-02-03 — — US disclosed
US-20220033388-A1 HDAC1,2 Inhibitors REGENACY PHARMACEUTICALS, LLC 2022-02-03 — — US disclosed
EP-3856174-A1 HDAC1,2 INHIBITORS Regenacy Pharmaceuticals, Inc. (US) 2021-08-04 — — EP disclosed
WO-2020068950-A1 HDAC1,2 INHIBITORS REGENACY PHARMACEUTICALS, LLC (US) 2020-04-02 — — 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 (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-11858919-B2 HDAC1,2 inhibitors HDAC1, HDAC2, HDAC11 HDAC2 2/4885POLB 678/4885RAD52 1647/4885
US-20220033388-A1 HDAC1,2 Inhibitors HDAC1, HDAC2, HDAC11 HDAC2 2/4885POLB 678/4885RAD52 1647/4885

“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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