SCHEMBL10196989

SCHEMBL10196989

CC(C)C(=O)Cc1cccc(O[Si](C)(C)C(C)(C)C)c1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
F10 P00742 1/20 0.44
HSP90AA1 P07900 1/20 0.39
HSP90AB1 P08238 1/20 0.39
CA12 O43570 3/20 0.38
CA1 P00915 3/20 0.38
CA9 Q16790 3/20 0.38
PSMB5 P28074 1/20 0.38
CTBP2 P56545 1/20 0.37
TAAR1 Q96RJ0 2/20 0.37
ITGA4 P13612 1/20 0.37
ITGB7 P26010 1/20 0.37
DRD2 P14416 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C19 P33261 1/20 0.36
DHFR P00374 1/20 0.36
PREP P48147 1/20 0.35
PPARD Q03181 1/20 0.35
GLS O94925 1/20 0.35

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
SCHEMBL3235704 0.86 CYP1A2 (0.49) HSP90AA1HSP90AB1CA12CA1CA9
SCHEMBL559379 0.86 DRD2 (0.39) HSP90AA1HSP90AB1CA12CA1CA9
SCHEMBL6362544 0.83 F10 (0.44) F10HSP90AA1HSP90AB1CA12CA1
SCHEMBL9340684 0.82 SLC7A5 (0.49) HSP90AA1HSP90AB1CTBP2DRD2GLS
SCHEMBL18294034 0.81 AOC2 (0.47) HSP90AA1HSP90AB1PSMB5CYP1A2GLS
SCHEMBL13534742 0.81 FFAR1 (0.49) HSP90AA1HSP90AB1CA12CA1CA9
SCHEMBL10697163 0.80 HSP90AA1 (0.41) HSP90AA1HSP90AB1CA12CA1CA9
SCHEMBL4190201 0.80 DRD2 (0.50) F10HSP90AA1HSP90AB1DRD2
SCHEMBL3175855 0.78 CTBP2 (0.57) CTBP2TAAR1CYP1A2
SCHEMBL559965 0.78 KDR (0.41) F10HSP90AA1HSP90AB1CA12CA1

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-9645128-B2 Substituted imidazo[1,2-A]pyrazines for measuring a transcription activity JNC CORPORATION (JP) 2017-05-09 US disclosed
US-20150344936-A1 COELENTERAZINE ANALOGS AND MANUFACTURING METHOD THEREOF TOKYO INSTITUTE OF TECHNOLOGY (JP) 2015-12-03 US disclosed
US-9151739-B2 Coelenterazine analogs and manufacturing method thereof JNC CORPORATION (JP) 2015-10-06 US disclosed
US-20140296521-A1 COELENTERAZINE ANALOGS AND MANUFACTURING METHOD THEREOF JNC CORP (JP) 2014-10-02 US disclosed
US-8765921-B2 Coelenterazine analogs and manufacturing method thereof JNC CORPORATION (JP) 2014-07-01 US disclosed
US-20140024058-A1 COELENTERAZINE ANALOGS AND MANUFACTURING METHOD THEREOF TOKYO INSTITUTE OF TECHNOLOGY (JP) 2014-01-23 US disclosed
US-8546568-B2 Coelenterazine analogs and manufacturing method thereof JNC CORPORATION (JP) 2013-10-01 US disclosed
US-20120035070-A1 COELENTERAZINE ANALOGS AND MANUFACTURING METHOD THEREOF TOKYO INSTITUTE OF TECHNOLOGY (JP) 2012-02-09 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 (2 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-20140296521-A1 COELENTERAZINE ANALOGS AND MANUFACTURING METHOD THEREOF GLB1, CEL, SI F10 1754/4885HSP90AA1 4169/4885HSP90AB1 4126/4885
US-20120035070-A1 COELENTERAZINE ANALOGS AND MANUFACTURING METHOD THEREOF GLB1, CEL, SI F10 1754/4885HSP90AA1 4169/4885HSP90AB1 4126/4885

“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.