SCHEMBL23055358

SCHEMBL23055358

CC(=O)N1CCN/C(=C2\C(=O)N(C3CCOCC3)c3ccc(N4CCCC4)cc32)CC1

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CREBBP Q92793 12/20 0.37
PIK3CD O00329 2/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
ALOX15 P16050 1/20 0.35
KMT2A Q03164 1/20 0.35
HSD17B10 Q99714 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
KIF11 P52732 5/20 0.35
BRD4 O60885 1/20 0.33

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
SCHEMBL23055357 0.85 MAPT (0.35) MEN1ALDH1A1MAPTALOX15KMT2A
SCHEMBL23055509 0.84 MAPT (0.34) PIK3CDMEN1ALDH1A1MAPTALOX15
SCHEMBL23055871 0.84 MAPT (0.36) MEN1ALDH1A1MAPTALOX15KMT2A
SCHEMBL23055875 0.82 MAPT (0.38) MEN1ALDH1A1MAPTALOX15KMT2A
SCHEMBL23055447 0.81 MAPT (0.37) MEN1ALDH1A1MAPTALOX15KMT2A
SCHEMBL23055661 0.80 MAPT (0.34) PIK3CDMEN1ALDH1A1MAPTALOX15
SCHEMBL23055493 0.77 MAPT (0.39) MEN1ALDH1A1MAPTALOX15KMT2A
SCHEMBL23055675 0.77 KDM4E (0.35) CREBBPALDH1A1HSD17B10BRD4
SCHEMBL23055851 0.77 KIF11 (0.40) PIK3CDALDH1A1MAPTL3MBTL1KIF11
SCHEMBL23055488 0.76 KIF11 (0.38) MEN1ALDH1A1MAPTALOX15KMT2A

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-11795147-B2 Modulators of complex I BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2023-10-24 US disclosed
US-11795147-B2 Modulators of complex I BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2023-10-24 US disclosed
US-20210061761-A1 MODULATORS OF COMPLEX I BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2021-03-04 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-20210061761-A1 MODULATORS OF COMPLEX I NDUFAB1, NDUFV1, NDUFB7 CREBBP 1175/4885PIK3CD 1901/4885MEN1 3979/4885
US-11795147-B2 Modulators of complex I NDUFAB1, NDUFV1, NDUFB7 CREBBP 1175/4885PIK3CD 1901/4885MEN1 3979/4885

“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.