SCHEMBL23055433

SCHEMBL23055433

O=C1/C(=C2/COCCN2)c2cc(NC3CCC3)ccc2N1C1COC1

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PRKCQ Q04759 3/20 0.34
PRMT5 O14744 1/20 0.31
WDR77 Q9BQA1 1/20 0.31
PTGS2 P35354 1/20 0.31
AR P10275 1/20 0.30

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
SCHEMBL23055349 0.98 PTGS2 (0.33) PRKCQPTGS2AR
SCHEMBL23055399 0.95 PRKCQ (0.34) PRKCQPRMT5WDR77PTGS2
SCHEMBL23055567 0.94 PRKCQ (0.35) PRKCQPRMT5WDR77PTGS2
SCHEMBL23055624 0.92 PRKCQ (0.34) PRKCQPRMT5WDR77PTGS2AR
SCHEMBL23055413 0.90 LMNA (0.33) PRKCQPRMT5WDR77PTGS2AR
SCHEMBL23055393 0.90 PRMT5 (0.34) PRKCQPRMT5WDR77
SCHEMBL23055903 0.89 PRMT5 (0.34) PRMT5WDR77
SCHEMBL23055862 0.88 PARP14 (0.32) PRKCQPRMT5WDR77
SCHEMBL23055574 0.88 PRMT5 (0.37) PRMT5WDR77
SCHEMBL23055383 0.85 DDB1 (0.37)

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 PRKCQ 1025/4885PRMT5 1411/4885WDR77 2245/4885
US-11795147-B2 Modulators of complex I NDUFAB1, NDUFV1, NDUFB7 PRKCQ 1025/4885PRMT5 1411/4885WDR77 2245/4885

“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.