SCHEMBL30044576

SCHEMBL30044576

CN1CCN(c2cc(NC(=O)OC(C)(C)C)c(N)cc2F)CC1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 3/20 0.45
HDAC8 Q9BY41 1/20 0.45
KDM4E B2RXH2 2/20 0.43
WDR5 P61964 8/20 0.42
ALDH1A1 P00352 3/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
HSD17B10 Q99714 1/20 0.40
KMT2A Q03164 1/20 0.39
RBBP5 Q15291 1/20 0.39
ASH2L Q9UBL3 1/20 0.39
HDAC1 Q13547 2/20 0.39
HDAC2 Q92769 2/20 0.39
GAA P10253 1/20 0.39
RAD52 P43351 1/20 0.39
HTT P42858 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
SCHEMBL23606384 1.00 HDAC3 (0.45) HDAC3HDAC8KDM4EWDR5ALDH1A1
SCHEMBL6166893 0.90 TSHR (0.42) KDM4EALDH1A1L3MBTL1KMT2AHDAC1
SCHEMBL21600858 0.90 WDR5 (0.38) HDAC3HDAC8KDM4EWDR5HDAC1
SCHEMBL30043999 0.87 ALDH1A1 (0.46) HDAC3HDAC8KDM4EALDH1A1HSD17B10
SCHEMBL23606371 0.87 ALDH1A1 (0.46) HDAC3HDAC8KDM4EALDH1A1HSD17B10
SCHEMBL30044351 0.87 WDR5 (0.41) HDAC3HDAC8KDM4EWDR5ALDH1A1
SCHEMBL23606834 0.87 WDR5 (0.41) HDAC3HDAC8KDM4EWDR5ALDH1A1
SCHEMBL25139785 0.84 ATR (0.42) HDAC3HDAC8WDR5HDAC1HDAC2
SCHEMBL30044991 0.84 ATR (0.42) HDAC3HDAC8WDR5HDAC1HDAC2
SCHEMBL21600789 0.83 FYN (0.41) HDAC3HDAC1HDAC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12582654-B2 Cyano-substituted pyridine and cyano-substituted pyrimidine compound and preparation method therefor and application thereof BEIJING SCITECH-MQ PHARMACEUTICALS LIMITED (CN) 2026-03-24 US disclosed
EP-4083021-B1 CYANO-SUBSTITUTED PYRIDINE AND CYANO-SUBSTITUTED PYRIMIDINE COMPOUND AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF BEIJING SCITECH MQ PHARMACEUTICALS LTD (CN) 2025-07-02 EP disclosed
US-20230125046-A1 CYANO-SUBSTITUTED PYRIDINE AND CYANO-SUBSTITUTED PYRIMIDINE COMPOUND AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF BEIJING SCITECH-MQ PHARMACEUTICALS LIMITED (CN) 2023-04-20 US disclosed
EP-4083021-A1 CYANO-SUBSTITUTED PYRIDINE AND CYANO-SUBSTITUTED PYRIMIDINE COMPOUND AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF Beijing Scitech-MQ Pharmaceuticals Limited (CN) 2022-11-02 EP 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-20230125046-A1 CYANO-SUBSTITUTED PYRIDINE AND CYANO-SUBSTITUTED PYRIMIDINE COMPOUND AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF FGFR4, FGFR1, WEE1 HDAC3 3231/4885HDAC8 1571/4885KDM4E 886/4885
US-12582654-B2 Cyano-substituted pyridine and cyano-substituted pyrimidine compound and preparation method therefor and application thereof FGFR4, FGFR3, FGFR1 HDAC3 1475/4885HDAC8 1543/4885KDM4E 1143/4885

“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.