SCHEMBL16242550

SCHEMBL16242550

[O]Cc1ccc(-n2cccc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
VHL P40337 1/20 0.61
ELOC Q15369 1/20 0.61
ELOB Q15370 1/20 0.61
POLB P06746 7/20 0.59
NSD2 O96028 1/20 0.59
GRK2 P25098 1/20 0.59
CASP6 P55212 1/20 0.59
CTDSP1 Q9GZU7 1/20 0.59
AOC2 O75106 3/20 0.52
L3MBTL1 Q9Y468 2/20 0.45
KDM4E B2RXH2 1/20 0.45
GAA P10253 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
MEN1 O00255 8/20 0.44
KMT2A Q03164 8/20 0.44
LMNA P02545 5/20 0.44
ALDH1A1 P00352 4/20 0.44
MAPT P10636 2/20 0.44
RECQL P46063 2/20 0.44
BLM P54132 1/20 0.44

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
SCHEMBL20319186 0.80 VHL (0.67) VHLELOCELOBPOLBNSD2
SCHEMBL13461836 0.76 VHL (0.61) VHLELOCELOBPOLBNSD2
SCHEMBL1260586 0.76 VHL (0.61) VHLELOCELOBPOLBNSD2
SCHEMBL4049582 0.76 VHL (1.00) VHLELOCELOBPOLBNSD2
SCHEMBL112197 0.76 VHL (0.61) VHLELOCELOBPOLBNSD2
SCHEMBL5603565 0.76 VHL (0.61) VHLELOCELOBPOLBNSD2
SCHEMBL28801815 0.74 VHL (0.59) VHLELOCELOBPOLBNSD2
SCHEMBL6790414 0.74 POLB (1.00) VHLELOCELOBPOLBNSD2
SCHEMBL5601606 0.73 VHL (0.57) VHLELOCELOBPOLBNSD2
SCHEMBL8797478 0.73 VHL (0.57) VHLELOCELOBPOLBNSD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10919874-B2 Metalloenzyme inhibitor compounds NQP 1598, LTD. (KY) 2021-02-16 US disclosed
US-20190382370-A1 METALLOENZYME INHIBITOR COMPOUNDS NQP 1598 LTD (KY) 2019-12-19 US disclosed
US-10370354-B2 Metalloenzyme inhibitor compounds NQP 1598, LTD. (KY) 2019-08-06 US disclosed
US-20180222884-A1 METALLOENZYME INHIBITOR COMPOUNDS NQP 1598, LTD. (KY) 2018-08-09 US disclosed
EP-3351541-A1 METALLOENZYME INHIBITOR COMPOUNDS Viamet Pharmaceuticals (NC), Inc. (US) 2018-07-25 EP disclosed
US-9938255-B2 Metalloenzyme inhibitor compounds VPS-3, INC. (US) 2018-04-10 US disclosed
EP-2788343-B1 METALLOENZYME INHIBITOR COMPOUNDS VIAMET PHARMACEUTICALS (NC) INC (US) 2018-02-28 EP disclosed
US-20160214959-A1 METALLOENZYME INHIBITOR COMPOUNDS NQP 1598, LTD. (KY) 2016-07-28 US disclosed
US-9309273-B2 Metalloenzyme inhibitor compounds VIAMET PHARMACEUTICALS, INC. (US) 2016-04-12 US disclosed
US-20140349973-A1 METALLOENZYME INHIBITOR COMPOUNDS VIAMET PHARMACEUTICALS, INC (US) 2014-11-27 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 (6 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-20190382370-A1 METALLOENZYME INHIBITOR COMPOUNDS MMEL1, GAA, GPX1 VHL 468/4885ELOC 3816/4885ELOB 2323/4885
US-10919874-B2 Metalloenzyme inhibitor compounds MMEL1, GAA, GPX1 VHL 468/4885ELOC 3816/4885ELOB 2323/4885
US-10370354-B2 Metalloenzyme inhibitor compounds MMEL1, GPX1, MPO VHL 529/4885ELOC 3945/4885ELOB 2379/4885
US-20180222884-A1 METALLOENZYME INHIBITOR COMPOUNDS MMEL1, GPX1, MPO VHL 529/4885ELOC 3945/4885ELOB 2379/4885
US-20140349973-A1 METALLOENZYME INHIBITOR COMPOUNDS MMEL1, GPX1, MPO VHL 529/4885ELOC 3945/4885ELOB 2379/4885
US-20160214959-A1 METALLOENZYME INHIBITOR COMPOUNDS MMEL1, GPX1, MPO VHL 529/4885ELOC 3945/4885ELOB 2379/4885

“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.