SCHEMBL21577698

SCHEMBL21577698

CC1CCN(C(=O)N2CCCCC2)CCN(C)C1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.52
LMNA P02545 2/20 0.44
HTT P42858 1/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
CA2 P00918 1/20 0.40
CHKA P35790 1/20 0.40
HSD11B1 P28845 1/20 0.40
TP53 P04637 1/20 0.40
LIPE Q05469 1/20 0.38
KDM4E B2RXH2 1/20 0.37
POLB P06746 1/20 0.37
MAPT P10636 1/20 0.37
HPGD P15428 1/20 0.37

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
SCHEMBL23874331 0.88 ALDH1A1 (0.54) ALDH1A1LMNAHTTMEN1KMT2A
SCHEMBL24242893 0.83 ALDH1A1 (0.61) ALDH1A1MEN1KMT2ACA2CHKA
SCHEMBL12243151 0.83 ALDH1A1 (0.61) ALDH1A1MEN1KMT2ACA2CHKA
SCHEMBL13779985 0.81 ALDH1A1 (0.48) ALDH1A1LMNAHTTMEN1KMT2A
SCHEMBL2606069 0.81 ALDH1A1 (0.56) ALDH1A1MEN1KMT2ACA2CHKA
SCHEMBL23815948 0.80 ALDH1A1 (0.50) ALDH1A1LMNAMEN1KMT2ATP53
SCHEMBL3437018 0.79 ALDH1A1 (0.75) ALDH1A1LMNAHTTMEN1KMT2A
SCHEMBL6997610 0.77 ALDH1A1 (0.70) ALDH1A1LMNAHTTMEN1KMT2A
SCHEMBL18855590 0.75 ALDH1A1 (0.50) ALDH1A1LMNAHTTMEN1KMT2A
SCHEMBL27889775 0.75 ALDH1A1 (0.48) ALDH1A1LMNAMEN1KMT2ALIPE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11066419-B2 1H-pyrrole-2,5-dione compounds and methods of using same Frequency Therapeutics, Inc. (US) 2021-07-20 US disclosed
US-20190352313-A1 1H-PYRROLE-2,5-DIONE COMPOUNDS AND METHODS OF USING THEM TO INDUCE SELF-RENEWAL OF STEM/PROGENITOR SUPPORTING CELLS Frequency Therapeutics, Inc. 2019-11-21 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 (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-11066419-B2 1H-pyrrole-2,5-dione compounds and methods of using same MKI67, PROX1, DCX ALDH1A1 30/4885LMNA 3598/4885HTT 2211/4885
US-20190352313-A1 1H-PYRROLE-2,5-DIONE COMPOUNDS AND METHODS OF USING THEM TO INDUCE SELF-RENEWAL OF STEM/PROGENITOR SUPPORTING CELLS MCL1, PROX1, MKI67 ALDH1A1 65/4885LMNA 3446/4885HTT 3555/4885

“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.