SCHEMBL1636987

SCHEMBL1636987

O=C(Sc1ccccc1)c1cccc(C#C[Au][PH](c2ccccc2)(c2ccccc2)c2ccccc2)c1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TTR P02766 2/20 0.39
MAPT P10636 3/20 0.35
ALDH1A1 P00352 2/20 0.32
S1PR2 O95136 1/20 0.32
HSP90AA1 P07900 1/20 0.32
OPRK1 P41145 1/20 0.32
HTT P42858 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C9 P11712 1/20 0.32
HPGD P15428 1/20 0.32
HSD17B10 Q99714 1/20 0.32
LMNA P02545 1/20 0.30
PTPN11 Q06124 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
SCHEMBL1637039 0.86 GRM5 (0.34) MAPTALDH1A1S1PR2HSP90AA1OPRK1
SCHEMBL1637054 0.83 ATM (0.47) MAPTALDH1A1CYP1A2HPGDHSD17B10
SCHEMBL1636983 0.82 ACACB (0.41) MAPTALDH1A1S1PR2HSP90AA1OPRK1
SCHEMBL1635696 0.78 ESR1 (0.37) MAPTALDH1A1S1PR2HSP90AA1OPRK1
SCHEMBL1636314 0.76 HPGD (0.50) MAPTALDH1A1HSP90AA1OPRK1CYP1A2
SCHEMBL28778381 0.74 TTR (0.47) TTRMAPTALDH1A1CYP1A2CYP2C9
SCHEMBL738373 0.73 ALDH1A1 (0.44) MAPTALDH1A1HPGDHSD17B10LMNA
SCHEMBL738590 0.72 APP (0.46) MAPTALDH1A1NPSR1CYP1A2CYP2C9
SCHEMBL1636350 0.71 TTR (0.40) TTRMAPTALDH1A1S1PR2HSP90AA1
SCHEMBL777000 0.69 TTR (0.57) TTRMAPTALDH1A1HTTHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2042506-B1 SUBSTITUTED PHENYLETHYNYL GOLD-NITROGENATED HETEROCYCLIC CARBENE COMPLEX UBE INDUSTRIES (JP) 2012-12-19 EP disclosed
US-7932398-B2 Substituted phenylethynylgold-nitrogen-containing heterocyclic carbene complex UBE INDUSTRIES, LTD. (JP) 2011-04-26 US disclosed
US-20090234130-A1 SUBSTITUTED PHENYLETHYNYLGOLD-NITROGEN-CONTAINING HETEROCYCLIC CARBENE COMPLEX UBE INDUSTRIES, LTD. (JP) 2009-09-17 US disclosed
EP-2042506-A1 SUBSTITUTED PHENYLETHYNYL GOLD-NITROGENATED HETEROCYCLIC CARBENE COMPLEX Ube Industries, Ltd. (JP) 2009-04-01 EP 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-20090234130-A1 SUBSTITUTED PHENYLETHYNYLGOLD-NITROGEN-CONTAINING HETEROCYCLIC CARBENE COMPLEX CCRL2, CCNL2, ATXN2L TTR 1002/4885MAPT 4610/4885ALDH1A1 3101/4885

“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.