SCHEMBL21157702

SCHEMBL21157702

O=C(O)c1cccc2c1OB(O)CC2NC(O)Cc1cccs1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CYP2C19 P33261 1/20 0.37
▸ CYP2C9 P11712 1/20 0.35
▸ KMT2A Q03164 3/20 0.33
▸ RAB9A P51151 3/20 0.32
▸ NPC1 O15118 2/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ CTSC P53634 2/20 0.32
▸ KDM4C Q9H3R0 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.31
▸ PKM P14618 1/20 0.31
▸ PARP1 P09874 1/20 0.31
▸ ADAM17 P78536 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ ALOX15 P16050 1/20 0.31
▸ HSD11B1 P28845 1/20 0.31

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
SCHEMBL18089666 0.82 SMN1; SMN2 (0.40) CYP2C9KMT2ARAB9ANPC1SMN1; SMN2
SCHEMBL19886702 0.73 POLB (0.42) KMT2ARAB9ANPC1SMN1; SMN2KDM4E
SCHEMBL18089740 0.70 ALDH1A1 (0.34) KDM4EPOLBLMNA
SCHEMBL18089423 0.70 ALDH1A1 (0.34) KDM4EPOLBLMNA
SCHEMBL21497101 0.68 CYP2C9 (0.34) CYP2C9KDM4EALOX15
SCHEMBL18089741 0.67 LMNA (0.33) KDM4EPOLBLMNA
SCHEMBL18089660 0.66 TP53 (0.36) PKMALOX15
SCHEMBL18089736 0.65 CYP2C9 (0.33) CYP2C9KMT2ARAB9ANPC1KDM4E
SCHEMBL15868268 0.64 SIGMAR1 (0.40) KMT2ARAB9ANPC1SMN1; SMN2KDM4E
SCHEMBL14751665 0.63 SIGMAR1 (0.39) KMT2ARAB9ASMN1; SMN2KDM4EPKM

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-20190211037-A1 BORONIC ACID DERIVATIVES AND THEIR THERAPEUTIC USES IN ANTIMICROBIAL TREATMENT REMPEX PHARMACEUTICALS, INC. 2019-07-11 — — 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-20190211037-A1 BORONIC ACID DERIVATIVES AND THEIR THERAPEUTIC USES IN ANTIMICROBIAL TREATMENT BTD, BCL6B, BPGM CYP2C19 2058/4885CYP2C9 2757/4885KMT2A 3512/4885

“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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