SCHEMBL19922286

SCHEMBL19922286

Cc1ccc(S(=O)(=O)n2cc(B3OC4(C)CC4(C)O3)cc2F)cc1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.39
▸ ELANE P08246 1/20 0.36
▸ PRTN3 P24158 1/20 0.36
▸ PKM P14618 4/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ HTT P42858 2/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ MMP2 P08253 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ TSHR P16473 2/20 0.34
▸ CA1 P00915 1/20 0.34
▸ CA2 P00918 1/20 0.34
▸ MCOLN3 Q8TDD5 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ P2RX4 Q99571 1/20 0.34
▸ RAPGEF4 Q8WZA2 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ RECQL P46063 1/20 0.34

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
SCHEMBL28897192 0.90 ELANE (0.38) KMT2AELANEPRTN3PKMMEN1
SCHEMBL14487909 0.78 ELANE (0.38) KMT2AELANEPRTN3PKMALDH1A1
SCHEMBL16318681 0.76 ALDH1A1 (0.37) ELANEPRTN3ALDH1A1CA1CA2
SCHEMBL22260778 0.73 PTPN11 (0.37) ELANEPRTN3PKMHTTPOLB
SCHEMBL16207740 0.72 CA1 (0.37) ELANEPRTN3MMP2TSHRCA1
SCHEMBL18951969 0.70 CA1 (0.49) KMT2APKMMEN1HTTALDH1A1
SCHEMBL4441787 0.70 CYP2C9 (0.41) KMT2AMEN1MMP2POLBTSHR
SCHEMBL31369076 0.70 KDM4E (0.39) ELANEPRTN3CA1CA2
SCHEMBL17518589 0.68 JAK2 (0.35) KMT2AELANEPRTN3PKMTSHR
SCHEMBL17518496 0.67 JAK2 (0.35) ELANEPRTN3PKMPOLBTSHR

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-20180065962-A1 METHODS OF PREPARING INHIBITORS OF INFLUENZA VIRUSES REPLICATION VERTEX PHARMACEUTICALS INCORPORATED 2018-03-08 — — 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-20180065962-A1 METHODS OF PREPARING INHIBITORS OF INFLUENZA VIRUSES REPLICATION POLRMT, POLM, POLR2H KMT2A 1075/4885ELANE 2866/4885PRTN3 450/4885

“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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