SCHEMBL21535952

SCHEMBL21535952

CCC(C)(C)C1=CCN(C(C)=O)CC1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
QDPR P09417 2/20 0.42
NOTUM Q6P988 1/20 0.37
PTAFR P25105 1/20 0.36
RIPK1 Q13546 1/20 0.33
NAMPT P43490 2/20 0.32
HRH3 Q9Y5N1 1/20 0.32
L3MBTL1 Q9Y468 2/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
ALDH1A1 P00352 1/20 0.31
EED O75530 1/20 0.31
RBBP4 Q09028 1/20 0.31
SUZ12 Q15022 1/20 0.31
EZH2 Q15910 1/20 0.31

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
SCHEMBL13851469 0.82 QDPR (0.46) QDPRNOTUMPTAFRNAMPT
SCHEMBL23561248 0.81 QDPR (0.39) QDPRNOTUMPTAFRRIPK1NAMPT
SCHEMBL19226549 0.78 QDPR (0.36) QDPRNAMPTALDH1A1
SCHEMBL21936851 0.75 NOTUM (0.39) QDPRNOTUMPTAFRRIPK1HRH3
SCHEMBL20115300 0.74 QDPR (0.36) QDPRL3MBTL1MEN1KMT2A
SCHEMBL13900834 0.74 QDPR (0.45) QDPRNOTUMPTAFRNAMPTHRH3
SCHEMBL20243870 0.72 TDO2 (0.37) EEDRBBP4SUZ12EZH2
SCHEMBL12139829 0.71 BLM (0.39) NAMPTMEN1KMT2AALDH1A1
SCHEMBL8261115 0.71 QDPR (0.49) QDPRNOTUMPTAFRNAMPTALDH1A1
SCHEMBL8386277 0.71 QDPR (0.53) QDPRNOTUMPTAFRNAMPTKMT2A

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-10919912-B2 Tricyclic heterocycles as BET protein inhibitors INCYTE HOLDINGS CORPORATION (US) 2021-02-16 US disclosed
US-20200131195-A1 TRICYCLIC HETEROCYCLES AS BET PROTEIN INHIBITORS INCYTE CORPORATION 2020-04-30 US disclosed
US-10464947-B2 Tricyclic heterocycles as BET protein inhibitors INCYTE HOLDINGS CORPORATION (US) 2019-11-05 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-20200131195-A1 TRICYCLIC HETEROCYCLES AS BET PROTEIN INHIBITORS BRD1, BRD3, BRD2 QDPR 4018/4885NOTUM 3538/4885PTAFR 3759/4885
US-10464947-B2 Tricyclic heterocycles as BET protein inhibitors BRD1, BRD3, BRD2 QDPR 4018/4885NOTUM 3538/4885PTAFR 3759/4885
US-10919912-B2 Tricyclic heterocycles as BET protein inhibitors BRD1, BRD3, BRD2 QDPR 4018/4885NOTUM 3538/4885PTAFR 3759/4885

“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.