SCHEMBL5870366

SCHEMBL5870366

COC(=O)C(Cc1cn(Cc2cc(Cl)cc(Cl)c2)c2ccccc12)N[C@@H](CC(C)C)C(=O)OC

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.45
ALDH1A1 P00352 2/20 0.45
ACE2 Q9BYF1 4/20 0.45
ACE P12821 3/20 0.45
KMT2A Q03164 2/20 0.44
ADAM17 P78536 5/20 0.43
HDAC10 Q969S8 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
CNR1 P21554 2/20 0.42
CNR2 P34972 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
BCL2 P10415 1/20 0.41
BCL2L1 Q07817 1/20 0.41
MCL1 Q07820 1/20 0.41
MMP2 P08253 1/20 0.41
MMP13 P45452 1/20 0.41
MMP14 P50281 1/20 0.41
MEN1 O00255 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41

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
SCHEMBL5870369 1.00 LMNA (0.45) LMNAALDH1A1ACE2ACEKMT2A
SCHEMBL5870367 1.00 LMNA (0.45) LMNAALDH1A1ACE2ACEKMT2A
SCHEMBL5869426 0.89 ACE2 (0.58) LMNAALDH1A1ACE2ACEKMT2A
SCHEMBL5869442 0.89 ACE2 (0.58) LMNAALDH1A1ACE2ACEKMT2A
SCHEMBL5869434 0.89 ACE2 (0.58) LMNAALDH1A1ACE2ACEKMT2A
SCHEMBL5869863 0.83 KMT2A (0.53) LMNAALDH1A1KMT2AHDAC10HDAC6
SCHEMBL5869869 0.83 KMT2A (0.53) LMNAALDH1A1KMT2AHDAC10HDAC6
SCHEMBL10380558 0.82 KMT2A (0.57) LMNAALDH1A1KMT2AADAM17HDAC10
SCHEMBL9584716 0.82 KMT2A (0.57) LMNAALDH1A1KMT2AADAM17HDAC10
SCHEMBL5870273 0.81 HDAC10 (0.50) LMNAALDH1A1ACEKMT2AADAM17

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-7045532-B2 ACE-2 modulating compounds and methods of use thereof MILLENNIUM PHARMACEUTICALS, INC. (US) 2006-05-16 US disclosed
US-20040082496-A1 ACE-2 modulating compounds and methods of use thereof MILLENNIUM PHARMACEUTICALS, INC. 2004-04-29 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-20040082496-A1 ACE-2 modulating compounds and methods of use thereof ACE, ACE2, AGTR2 LMNA 3320/4885ALDH1A1 1305/4885ACE2 2/4885

“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.