SCHEMBL2598141

SCHEMBL2598141

[Na][Si](c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.36
ESR2 Q92731 1/20 0.36
ALDH1A1 P00352 3/20 0.35
RAB9A P51151 2/20 0.33
NPC1 O15118 1/20 0.33
MAPK1 P28482 1/20 0.33
KDM4E B2RXH2 1/20 0.33
HPGD P15428 1/20 0.33
KMT2A Q03164 2/20 0.32
GAA P10253 1/20 0.32
NOTUM Q6P988 1/20 0.32
TSHR P16473 3/20 0.32
TDP1 Q9NUW8 3/20 0.32
CA1 P00915 2/20 0.32
CA2 P00918 2/20 0.32
CA9 Q16790 2/20 0.32
CA12 O43570 1/20 0.32
GLA P06280 1/20 0.32
CA3 P07451 1/20 0.32
CA4 P22748 1/20 0.32

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
SCHEMBL8386069 0.73 ESR1 (0.44) ESR1ESR2ALDH1A1RAB9ANPC1
SCHEMBL8384580 0.73 ESR1 (0.44) ESR1ESR2ALDH1A1RAB9ANPC1
SCHEMBL242095 0.69 ALDH1A1 (0.40) ESR1ESR2ALDH1A1RAB9ANPC1
SCHEMBL464991 0.69 ALDH1A1 (0.40) ESR1ESR2ALDH1A1RAB9ANPC1
SCHEMBL8385033 0.67 ESR1 (0.34) ESR1ESR2ALDH1A1MAPK1TSHR
SCHEMBL15975758 0.67 ESR1 (0.43) ESR1ESR2ALDH1A1RAB9ANPC1
SCHEMBL126319 0.67 ESR1 (0.43) ESR1ESR2ALDH1A1RAB9ANPC1
SCHEMBL12879524 0.67 ESR1 (0.43) ESR1ESR2ALDH1A1RAB9ANPC1
SCHEMBL103830 0.67 ESR1 (0.43) ESR1ESR2ALDH1A1RAB9ANPC1
SCHEMBL15975757 0.67 ESR1 (0.43) ESR1ESR2ALDH1A1RAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8987493-B2 Process for synthesis of silane dipeptide analogs Temple University—Of the Commonwealth System of Higher Education (US) 2015-03-24 US disclosed
US-20130096335-A1 PROCESS FOR SYNTHESIS OF SILANE DIPEPTIDE ANALOGS TEMPLE UNIVERSITY - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2013-04-18 US disclosed
WO-2011146842-A1 PROCESS FOR SYNTHESIS OF SILANE DIPEPTIDE ANALOGS TEMPLE UNIVERSITY - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2011-11-24 WO disclosed
EP-0630933-B1 A method of producing a semiconducting material NIPPON OIL CO LTD (JP) 1999-04-14 EP disclosed
US-5700400-A Method for producing a semiconducting material NIPPON OIL CO., LTD. (JP) 1997-12-23 US disclosed
EP-0551771-B1 Process for producing polysilanes NIPPON OIL CO LTD (JP) 1997-07-30 EP disclosed
US-5620531-A Photovoltaic element NIPPON OIL CO., LTD. (JP) 1997-04-15 US disclosed
EP-0717451-A2 Photovoltaic element NIPPON OIL CO., LTD. (JP) 1996-06-19 EP disclosed
EP-0630933-A2 A method of producing a semiconducting material NIPPON OIL CO. LTD. (JP) 1994-12-28 EP disclosed
US-5304622-A Process for producing polysilanes NIPPON OIL COMPANY, LTD. (JP) 1994-04-19 US disclosed
EP-0551771-A2 Process for producing polysilanes NIPPON OIL CO. LTD. (JP) 1993-07-21 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-20130096335-A1 PROCESS FOR SYNTHESIS OF SILANE DIPEPTIDE ANALOGS VIP, DNPEP, SSTR4 ESR1 2920/4885ESR2 2708/4885ALDH1A1 4009/4885

“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.