SCHEMBL15919682

SCHEMBL15919682

O=C(O)c1cc(-c2ccc(Br)cc2)no1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 7/20 0.56
SMN1; SMN2 Q16637 2/20 0.51
RAB9A P51151 1/20 0.51
MCL1 Q07820 4/20 0.50
HCAR2 Q8TDS4 1/20 0.47
RXFP1 Q9HBX9 1/20 0.45
KDM4E B2RXH2 1/20 0.45
MEN1 O00255 1/20 0.44
ALDH1A1 P00352 1/20 0.44
KMT2A Q03164 1/20 0.44
TP53 P04637 1/20 0.43
MAPT P10636 1/20 0.43

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
SCHEMBL11619922 0.93 PTPN1 (0.57) PTPN1SMN1; SMN2RAB9AHCAR2KDM4E
SCHEMBL212382 0.85 RAB9A (0.68) PTPN1SMN1; SMN2RAB9AHCAR2KDM4E
SCHEMBL8880032 0.84 HCAR2 (0.55) PTPN1SMN1; SMN2RAB9AHCAR2RXFP1
SCHEMBL3611504 0.84 PTPN1 (0.57) PTPN1SMN1; SMN2RAB9AMEN1ALDH1A1
SCHEMBL3989188 0.84 LMNA (0.51) PTPN1SMN1; SMN2RAB9AMCL1KDM4E
SCHEMBL3101558 0.84 PTPN1 (0.64) PTPN1SMN1; SMN2RAB9AHCAR2KDM4E
Hydrochloric Acid SCHEMBL8880218 0.84 RAB9A (0.66) PTPN1SMN1; SMN2RAB9AHCAR2KDM4E
SCHEMBL7999942 0.83 PTPN1 (0.50) PTPN1SMN1; SMN2RAB9AHCAR2KDM4E
Hydrochloric Acid SCHEMBL8878911 0.83 HCAR2 (0.53) PTPN1SMN1; SMN2RAB9AHCAR2RXFP1
Hydrochloric Acid SCHEMBL6822320 0.83 PTPN1 (0.56) PTPN1SMN1; SMN2RAB9AMEN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180273906-A1 MICROVESICLE AND STEM CELL COMPOSITIONS FOR THERAPEUTIC APPLICATIONS IPS HEART 2018-09-27 US claimed
US-20210054344-A1 CPC EXOSOMES MIRNA373 COMBINATION THERAPIES IPS HEART 2021-02-25 US disclosed
US-20180273906-A1 MICROVESICLE AND STEM CELL COMPOSITIONS FOR THERAPEUTIC APPLICATIONS IPS HEART 2018-09-27 US disclosed
US-9663488-B2 Metalloenzyme inhibitor compounds VIAMET PHARMACEUTICALS, INC. (US) 2017-05-30 US disclosed
US-9663488-B2 Metalloenzyme inhibitor compounds VIAMET PHARMACEUTICALS, INC. (US) 2017-05-30 US disclosed
US-20150353546-A1 METALLOENZYME INHIBITOR COMPOUNDS Viamet Pharmaceuticals (NC), Inc. 2015-12-10 US disclosed
US-20150353546-A1 METALLOENZYME INHIBITOR COMPOUNDS Viamet Pharmaceuticals (NC), Inc. 2015-12-10 US disclosed
WO-2014117090-A1 METALLOENZYME INHIBITOR COMPOUNDS VIAMET PHARMACEUTICALS, INC. (US) 2014-07-31 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-20150353546-A1 METALLOENZYME INHIBITOR COMPOUNDS MMEL1, GPX1, MPO PTPN1 1441/4885SMN1; SMN2 1142/4885RAB9A 2721/4885
US-20180273906-A1 MICROVESICLE AND STEM CELL COMPOSITIONS FOR THERAPEUTIC APPLICATIONS EXOSC9, EXOSC5, EXOSC4 PTPN1 3314/4885SMN1; SMN2 14/4885RAB9A 334/4885
US-20210054344-A1 CPC EXOSOMES MIRNA373 COMBINATION THERAPIES EXOSC5, UTRN, EXOSC4 PTPN1 3176/4885SMN1; SMN2 13/4885RAB9A 2257/4885

“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.