SCHEMBL16828262

SCHEMBL16828262

CC(CCCCNC(=O)CBr)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LTA4H P09960 1/20 0.43
▸ BLM P54132 1/20 0.43
▸ HDAC3 O15379 2/20 0.42
▸ HDAC4 P56524 2/20 0.42
▸ HDAC1 Q13547 2/20 0.42
▸ HDAC7 Q8WUI4 2/20 0.42
▸ HDAC2 Q92769 2/20 0.42
▸ HDAC10 Q969S8 2/20 0.42
▸ HDAC11 Q96DB2 2/20 0.42
▸ HDAC8 Q9BY41 2/20 0.42
▸ HDAC6 Q9UBN7 2/20 0.42
▸ HDAC9 Q9UKV0 2/20 0.42
▸ HDAC5 Q9UQL6 2/20 0.42
▸ KMT2A Q03164 2/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ ACE2 Q9BYF1 1/20 0.41
▸ GABRR1 P24046 2/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ ITGB3 P05106 1/20 0.38
▸ ITGA2B P08514 1/20 0.38

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
SCHEMBL20900404 0.84 MEN1 (0.63) LTA4HBLMKMT2AMEN1ACE2
SCHEMBL14217283 0.84 MEN1 (0.63) LTA4HBLMKMT2AMEN1ACE2
SCHEMBL19069625 0.82 LTA4H (0.43) LTA4HBLMKMT2AMEN1ACE2
SCHEMBL15726583 0.81 HDAC3 (0.44) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL19069567 0.81 CASP2 (0.59) LTA4HBLMKMT2AMEN1ACE2
SCHEMBL21261702 0.81 ALDH1A1 (0.43) LTA4HBLMKMT2AMEN1ACE2
SCHEMBL12413859 0.81 CYP1A2 (0.52) LTA4HBLMKMT2AMEN1ACE2
SCHEMBL14930734 0.79 KDM4E (0.58) LTA4HBLMACE2GABRR1CYP1A2
SCHEMBL18588225 0.79 KDM4E (0.58) LTA4HBLMACE2GABRR1CYP1A2
SCHEMBL20788037 0.79 HDAC3 (0.41) HDAC3HDAC4HDAC1HDAC7HDAC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11692043-B2 Peptidomimetic compounds and antibody-drug conjugates thereof MEDIMMUNE LIMITED (GB) 2023-07-04 — — US disclosed
EP-3082872-B1 PEPTIDOMIMETIC COMPOUNDS AND ANTIBODY-DRUG CONJUGATES THEREOF GENENTECH INC (US) 2020-12-09 — — EP disclosed
US-20200157240-A1 PEPTIDOMIMETIC COMPOUNDS AND ANTIBODY-DRUG CONJUGATES THEREOF MEDIMMUNE LIMITED (GB) 2020-05-21 — — US disclosed
US-20160310611-A1 PEPTIDOMIMETIC COMPOUNDS AND ANTIBODY-DRUG CONJUGATES THEREOF GENENTECH INC. (US) 2016-10-27 — — US disclosed
EP-3082872-A1 PEPTIDOMIMETIC COMPOUNDS AND ANTIBODY-DRUG CONJUGATES THEREOF Genentech, Inc. (US) 2016-10-26 — — EP disclosed
WO-2015095124-A1 PEPTIDOMIMETIC COMPOUNDS AND ANTIBODY-DRUG CONJUGATES THEREOF GENENTECH INC. (US) 2015-06-25 — — WO 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 (3 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-20200157240-A1 PEPTIDOMIMETIC COMPOUNDS AND ANTIBODY-DRUG CONJUGATES THEREOF DNPEP, LNPEP, VIP LTA4H 3290/4885BLM 3294/4885HDAC3 3284/4885
US-11692043-B2 Peptidomimetic compounds and antibody-drug conjugates thereof DNPEP, LNPEP, VIP LTA4H 3290/4885BLM 3294/4885HDAC3 3284/4885
US-20160310611-A1 PEPTIDOMIMETIC COMPOUNDS AND ANTIBODY-DRUG CONJUGATES THEREOF DNPEP, BCR, LNPEP LTA4H 3354/4885BLM 3263/4885HDAC3 3163/4885

“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.

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