SCHEMBL29344854

SCHEMBL29344854

CCOC(=O)Cc1cc(COC)ccc1OCc1c2cc(-c3ccc4ccnc(N)c4c3)ccc2nn1[C@H]1CCN(CCO)C1

nearest known ligand 0.32

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MTOR P42345 2/20 0.31
KMT2A Q03164 2/20 0.31
POLB P06746 1/20 0.31
KDM4E B2RXH2 2/20 0.31
ALDH1A1 P00352 2/20 0.31
MAPT P10636 2/20 0.31
MEN1 O00255 1/20 0.31
LMNA P02545 1/20 0.31
AHR P35869 1/20 0.31
CFD P00746 1/20 0.30
GLA P06280 1/20 0.30
GAA P10253 1/20 0.30
HPGD P15428 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL29344953 0.95 KDM4E (0.32) KMT2APOLBKDM4EALDH1A1MAPT
SCHEMBL29344881 0.91 ABL1 (0.31) CFD
SCHEMBL31018871 0.91 CFD (0.37) MTORKMT2APOLBKDM4EALDH1A1
SCHEMBL29340366 0.91 CFD (0.37) MTORKMT2APOLBKDM4EALDH1A1
SCHEMBL29346651 0.90 CFD (0.34) KMT2APOLBCFD
SCHEMBL29345235 0.87 KDM4E (0.33) KMT2APOLBKDM4EALDH1A1MAPT
SCHEMBL31018862 0.87 CFD (0.36) MTORKMT2APOLBKDM4EALDH1A1
SCHEMBL29340387 0.87 CFD (0.36) MTORKMT2APOLBKDM4EALDH1A1
SCHEMBL29344778 0.86 SRC (0.39) MTORKMT2APOLBKDM4EALDH1A1
SCHEMBL29121915 0.85 CFD (0.39) KMT2APOLBKDM4EALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240239752-A1 BICYCLIC HETEROAROMATIC INHIBITORS OF KLK5 WILMINGTON TRUST, NATIONAL ASSOCIATION 2024-07-18 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 (1 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-20240239752-A1 BICYCLIC HETEROAROMATIC INHIBITORS OF KLK5 KLK5, KLK1, KLKB1 MTOR 2746/4885KMT2A 1480/4885POLB 1866/4885

“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.