SCHEMBL20848346

SCHEMBL20848346

CN(C(=O)OC(C)(C)C)C12CC(CO)(C1)C2

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ASGR1 P07306 1/20 0.38
HDAC6 Q9UBN7 2/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC2 Q92769 1/20 0.33
CTSD P07339 1/20 0.31
CTSL P07711 1/20 0.31
CTSB P07858 1/20 0.31
CTSS P25774 1/20 0.31
NFKB1 P19838 1/20 0.30
NFKB2 Q00653 1/20 0.30
RELA Q04206 1/20 0.30
BRD4 O60885 1/20 0.30
CREBBP Q92793 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
SCHEMBL30885813 0.84 ASGR1 (0.32) ASGR1HDAC6HDAC1HDAC2CTSD
SCHEMBL23539397 0.83 GRM1 (0.34) ASGR1HDAC6HDAC1HDAC2
SCHEMBL23225475 0.83 ASGR1 (0.32) ASGR1HDAC6HDAC1HDAC2
SCHEMBL23539122 0.80 FOLH1 (0.33) ASGR1HDAC6HDAC1HDAC2
SCHEMBL30059357 0.80 CTSS (0.36) ASGR1CTSDCTSLCTSBCTSS
SCHEMBL17586292 0.79 ASGR1 (0.32) ASGR1HDAC6HDAC1HDAC2CTSD
SCHEMBL17582445 0.79 ASGR1 (0.33) ASGR1
SCHEMBL23284466 0.78 ASGR1 (0.31) ASGR1HDAC6HDAC1HDAC2
SCHEMBL17586283 0.78 ASGR1 (0.31) ASGR1HDAC6HDAC1HDAC2
SCHEMBL19373428 0.78

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-20230026872-A1 METHODS FOR TREATING HEMATOLOGICAL MALIGNANCIES AND EWING'S SARCOMA KURA ONCOLOGY, INC. 2023-01-26 US disclosed
US-10752639-B2 Bridged bicyclic inhibitors of menin-MLL and methods of use KURA ONCOLOGY, INC. (US) 2020-08-25 US disclosed
US-20190092783-A1 BRIDGED BICYCLIC INHIBITORS OF MENIN-MLL AND METHODS OF USE KURA ONCOLOGY, INC. (US) 2019-03-28 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 (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-20230026872-A1 METHODS FOR TREATING HEMATOLOGICAL MALIGNANCIES AND EWING'S SARCOMA MEN1, DIAPH1, EWSR1 ASGR1 2966/4885HDAC6 572/4885HDAC1 1092/4885
US-10752639-B2 Bridged bicyclic inhibitors of menin-MLL and methods of use MLLT1, MEN1, MLLT3 ASGR1 4287/4885HDAC6 1568/4885HDAC1 89/4885
US-20190092783-A1 BRIDGED BICYCLIC INHIBITORS OF MENIN-MLL AND METHODS OF USE MLLT1, MEN1, BMI1 ASGR1 4307/4885HDAC6 1663/4885HDAC1 204/4885

“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.