SCHEMBL20535649

SCHEMBL20535649

Cc1nc(S)nn1-c1ccc(Cl)cc1Cl

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.47
HTT P42858 1/20 0.47
L3MBTL1 Q9Y468 2/20 0.44
OPRM1 P35372 2/20 0.44
KDM4E B2RXH2 1/20 0.44
CNR2 P34972 3/20 0.43
CNR1 P21554 2/20 0.43
CDK4 P11802 1/20 0.41
CCND1 P24385 1/20 0.41
OPRD1 P41143 1/20 0.41
OPRK1 P41145 1/20 0.41
KMT2A Q03164 1/20 0.40
HSD11B1 P28845 1/20 0.40
OPRL1 P41146 1/20 0.40
KCNH2 Q12809 1/20 0.40
CACNA2D1 P54289 1/20 0.40
CACNA2D2 Q9NY47 1/20 0.40
RPA1 P27694 1/20 0.40

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
SCHEMBL12180309 0.83 LMNA (0.49) LMNAHTTL3MBTL1OPRM1KDM4E
SCHEMBL2268882 0.81 HTT (0.50) LMNAHTTL3MBTL1OPRM1KDM4E
SCHEMBL10729168 0.76 HTT (0.80) LMNAHTTL3MBTL1KDM4ECNR2
SCHEMBL10849530 0.73 LMNA (0.52) LMNAHTTL3MBTL1KDM4ECNR2
SCHEMBL238439 0.72 GAA (0.46) LMNAHTTL3MBTL1KDM4EKCNH2
SCHEMBL14996637 0.71 LMNA (0.50) LMNAL3MBTL1OPRM1CNR2CNR1
SCHEMBL3685546 0.71 KDM4E (0.51) LMNAHTTL3MBTL1OPRM1KDM4E
SCHEMBL10731562 0.71 KMT2A (0.69) HTTL3MBTL1KDM4EKMT2A
SCHEMBL11435978 0.69 LMNA (0.51) LMNAL3MBTL1OPRM1CNR2CNR1
SCHEMBL11652491 0.69 LMNA (0.51) LMNAL3MBTL1OPRM1CNR2CNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110546140-B Selective HDAC6 inhibitors 意大发马克股份公司 2023-05-16 CN disclosed
EP-3562810-B1 BENZHYDROXAMIC ACID DERIVATIVES AS SELECTIVE HDAC6 INHIBITORS ITALFARMACO SPA (IT) 2023-05-03 EP disclosed
EP-3562810-B1 BENZHYDROXAMIC ACID DERIVATIVES AS SELECTIVE HDAC6 INHIBITORS ITALFARMACO SPA (IT) 2023-05-03 EP disclosed
US-11351178-B2 Selective HDAC6 inhibitors ITALFARMACO SPA (IT) 2022-06-07 US disclosed
US-11351178-B2 Selective HDAC6 inhibitors ITALFARMACO SPA (IT) 2022-06-07 US disclosed
US-20210128577-A1 Selective HDAC6 Inhibitors ITALFARMACO S.P.A. (IT) 2021-05-06 US disclosed
US-20210128577-A1 Selective HDAC6 Inhibitors ITALFARMACO S.P.A. (IT) 2021-05-06 US disclosed
CN-110546140-A selective HDAC6 inhibitors ITALFARMACO SPA 2019-12-06 CN disclosed
EP-3562810-A1 SELECTIVE HDAC6 INHIBITORS Italfarmaco SpA (IT) 2019-11-06 EP disclosed
WO-2018189340-A1 SELECTIVE HDAC6 INHIBITORS ITALFARMACO S.P.A. (IT) 2018-10-18 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-20210128577-A1 Selective HDAC6 Inhibitors HDAC6, HDAC1, HDAC3 LMNA 4062/4885HTT 359/4885L3MBTL1 1957/4885
US-11351178-B2 Selective HDAC6 inhibitors HDAC6, HDAC1, HDAC3 LMNA 4000/4885HTT 346/4885L3MBTL1 2151/4885

“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.